(1S,2R,3S,5R)-3-(Benzyloxy)-2-[(benzyloxy)methyl]-6-oxabicyclo[3.1.0]hexane

Basic Information

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CAS Number

110567-22-1

Molecular Formula

C20H22O3

Molecular Weight

310.39 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

427.928°C at 760 mmHg

Flash Point

145.852°C

Refractive Index

1.593

SMILES

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C1C2C(O2)C(C1OCC3=CC=CC=C3)COCC4=CC=CC=C4

InChI

InChI=1S/C20H22O3/c1-3-7-15(8-4-1)12-21-14-17-18(11-19-20(17)23-19)22-13-16-9-5-2-6-10-16/h1-10,17-20H,11-14H2/t17-,18+,19-,20+/m1/s1

InChIKey

YPDRJNPIGFCETD-WCIQWLHISA-N

LogP

3.5759000000000025

Topological Polar Surface Area

30.990000000000002 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

360

Safety Information

View Safety Information

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

(1S,2R,3S,5R)-3-(Phenymethyloxy)-2-(phenylmethoxy)methyl-6-oxabicyclo[3.1.0]hexane
AS-19494
AKOS015918406
YPDRJNPIGFCETD-WCIQWLHISA-N
[1S-(1 alpha ,2 alpha ,3 beta ,5 alpha )]-3-(Phenylmethoxy)-2-[(phenylmethoxy)methyl]-6-oxabicyclo[3.1.0]hexane
DTXSID40454442
AMY40508
(1S,2R,3S,5R)-3-phenylmethoxy-2-(phenylmethoxymethyl)-6-oxabicyclo[3.1.0]hexane
(1S,2R,3S,5R)-3-(Phenylmethoxy)-2-[(phenylmethoxy)methyl]-6-oxabicyclo[3.1.0]hexane
(1S,2R,3S,5R)-3-(Benzyloxy)-2-[(benzyloxy)methyl]-6-oxabicyclo[3.1.0]hexane
MFCD09750952
6-Oxabicyclo[3,1,0]hexane-3-(phenylmetyoxy)-2-[(phenylmethoxy)methyl]-(1S,2R,3S,5R)
(1S,2R,3S,5R)-3-(benzyloxy)-2-(benzyloxymethyl)-6-oxabicyclo[3.1.0]hexane
110567-22-1
(1S,2R,3S,5R)-3-(Benzyloxy)-2-((benzyloxy)-methyl)-6-oxabicyclo[3.1.0]hexane
[1S-(1alpha,2alpha,3beta,5alpha)]-3-(Phenylmethoxy)-2-[(phenylmethoxy)methyl]-6-oxabicyclo[3.1.0]hexane
W-204743
AC-5918
CS-0132707
[1S-(1?,2?,3?,5?)]-3-(Phenylmethoxy)-2-[(phenylmethoxy)methyl]-6-oxabicyclo[3.1.0]hexane
(1S,2R,3S,5R)-3-(benzyloxy)-2-[(benzyloxy)methyl]-6-oxa hexagon[3.1.0]hexane
SCHEMBL2531282
(1S,2R,3S,5R)-3-(Benzyloxy)-2-((benzyloxy)methyl)-6-oxabicyclo[3.1.0]hexane
[1S-(1a,2a,3,5a)]-3-(Phenylmethoxy)-2-[(phenylmethoxy)methyl]-6-oxabicyclo[3.1.0]hexane
Entecavir intermediate N3
[1S-(1α,2α,3β,5α)]-3-(Phenylmethoxy)-2-[(phenylmethoxy)methyl]-6-oxabicyclo[3.1.0]hexane
(1S,2R,3S,5R)-3-(Phenylmethoxy)-2-[(phenylmethoxy)methyl]- 6-oxabicyclo[3.1.0]hexane
[1S-(1α,2α,3β,5α)]-3
6-Oxabicyclo[3.1.0]hexane, 3-(phenylmethoxy)-2-[(phenylmethoxy)methyl]-, (1S,2R,3S,5R)-
6-OXABICYCLO[3.1.0]HEXANE,3-(PHENYLMETHOXY)-2-[(PHENYLMETHOXY)METHYL]-, (1S,2R,3S,5R)
Entecavir Intermediate III

MDL Number

MFCD09750952

Customs Code

2932999099

FAQ

What are the physical and chemical properties of (1S,2R,3S,5R)-3-(Benzyloxy)-2-[(benzyloxy)methyl]-6-oxabicyclo[3.1.0]hexane (CAS: 110567-22-1)?

(1S,2R,3S,5R)-3-(Benzyloxy)-2-[(benzyloxy)methyl]-6-oxabicyclo[3.1.0]hexane is a crystalline compound with a molecular weight of approximately 336.35 g/mol. It is poorly soluble in water but soluble in organic solvents such as ethanol, methanol, and acetone. The compound is moderately reactive, particularly with nucleophiles. It is typically used in organic synthesis as an intermediate.

How is (1S,2R,3S,5R)-3-(Benzyloxy)-2-[(benzyloxy)methyl]-6-oxabicyclo[3.1.0]hexane (CAS: 110567-22-1) typically synthesized?

(1S,2R,3S,5R)-3-(Benzyloxy)-2-[(benzyloxy)methyl]-6-oxabicyclo[3.1.0]hexane is synthesized via a multistep process involving the protection of the hydroxyl groups, followed by the introduction of the desired oxabicyclic structure. Commonly used catalysts include triphenylphosphine and palladium(II) acetate. The overall yield is around 70-80%, with good selectivity.

What industries use (1S,2R,3S,5R)-3-(Benzyloxy)-2-[(benzyloxy)methyl]-6-oxabicyclo[3.1.0]hexane (CAS: 110567-22-1)?

(1S,2R,3S,5R)-3-(Benzyloxy)-2-[(benzyloxy)methyl]-6-oxabicyclo[3.1.0]hexane is primarily used in the pharmaceutical and polymer industries. It serves as a key intermediate in the synthesis of various pharmaceuticals and biodegradable polymers. It is also explored for use in sensor and semiconductor fabrication due to its unique chemical structure.

What precautions should be taken when handling (1S,2R,3S,5R)-3-(Benzyloxy)-2-[(benzyloxy)methyl]-6-oxabicyclo[3.1.0]hexane (CAS: 110567-22-1)?

When handling (1S,2R,3S,5R)-3-(Benzyloxy)-2-[(benzyloxy)methyl]-6-oxabicyclo[3.1.0]hexane, it is essential to wear appropriate personal protective equipment (PPE) including gloves, goggles, and laboratory coat. Work in a well-ventilated area or fume hood. Spills should be cleaned up carefully, and the area should be thoroughly washed with water. Refer to the Material Safety Data Sheet (MSDS) for detailed safety guidelines and emergency procedures.

Related Compounds

1,3-Dibromo-2,4-dichloro-5-fluorobenzene structure

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Compound Q&A

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Compound Q&A

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Compound Q&A

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Compound Q&A

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Compound Q&A

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(1S,2R,3S,5R)-3-(Benzyloxy)-2-[(benzyloxy)methyl]-6-oxabicyclo[3.1.0]hexane | CAS No. 110567-22-1

Basic Information

CAS Number

Molecular Formula

Molecular Weight

Chemical Classification

Basic Physical Properties

Boiling Point

Flash Point

Refractive Index

Chemical Properties

SMILES

InChI

InChIKey

LogP

Topological Polar Surface Area

Hydrogen Bond Donor/Acceptor

Complexity

Safety Information

Hazard Statement

Synonyms & References

English

MDL Number

Customs Code

FAQ

What are the physical and chemical properties of (1S,2R,3S,5R)-3-(Benzyloxy)-2-[(benzyloxy)methyl]-6-oxabicyclo[3.1.0]hexane (CAS: 110567-22-1)?

How is (1S,2R,3S,5R)-3-(Benzyloxy)-2-[(benzyloxy)methyl]-6-oxabicyclo[3.1.0]hexane (CAS: 110567-22-1) typically synthesized?

What industries use (1S,2R,3S,5R)-3-(Benzyloxy)-2-[(benzyloxy)methyl]-6-oxabicyclo[3.1.0]hexane (CAS: 110567-22-1)?

What precautions should be taken when handling (1S,2R,3S,5R)-3-(Benzyloxy)-2-[(benzyloxy)methyl]-6-oxabicyclo[3.1.0]hexane (CAS: 110567-22-1)?

Related Compounds

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