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(1S,2R,4S)-1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl 3-methylbutanoate | CAS No. 76-50-6

(1S,2R,4S)-1,7,7-Trimethylbicyclo[2.2.1]hept-2-yl 3-methylbutanoate

Basic Information

Chemical_Structure_Of

CAS Number

76-50-6

Molecular Formula

C15H26O2

Molecular Weight

238.37 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

255-260 ºC

Density

0.949

Flash Point

>110 ºC

Refractive Index

1.46

Specific Rotation

-32.5 º (neat)

SMILES

CC(C)CC(=O)OC1CC2CCC1(C2(C)C)C

InChI

InChI=1S/C15H26O2/c1-10(2)8-13(16)17-12-9-11-6-7-15(12,5)14(11,3)4/h10-12H,6-9H2,1-5H3/t11-,12+,15+/m0/s1

InChIKey

MPYYVGIJHREDBO-YWPYICTPSA-N

LogP

3.7905000000000033

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

319

Synonyms & References

English

Bornyl 3-methylbutanoate
EINECS 231-935-4
W-104361
endo-1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 3-methylbutanoate
SCHEMBL309489
76-50-6
Isobornyl 3-methylbutanoate
Butanoic acid, 3-methyl-, (1R,2S,4R)-1,7,7-trimethylbicyclo(2.2.1)hept-2-yl ester, rel-
(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl) 3-methylbutanoate
Iso-valerianate de bornyle [French]
1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl 3-methylbutanoate
MPYYVGIJHREDBO-UHFFFAOYSA-N
BORNYL ISOVALERATE
(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl) 3-methylbutanoate
7779-73-9
Bornyl isopentanoate
Isobornyl isovalerate
endo-3-Methylbutanoic acid 1,7,7-trimethylbicyclo(2.2.1)hept-2-yl ester
DTXSID80873577
Isobornyl isovalerianate
Butanoic acid, 3-methyl-, (1R,2R,4R)-1,7,7-trimethylbicyclo(2.2.1)hept-2-yl ester, rel-
Isovaleric acid, 2-bornyl ester
UNII-X58D56297G
EINECS 200-966-5
(-)-Bornyl isovalerate, >=97%
endo-bornylisovalerat
Bornyval
Isobornyl isopentanoate
Bornyl isovalerianate
exo - bornyl isovalerate
1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl 3-methylbutanoate, exo

MDL Number

MFCD00053464

Related Compounds

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

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

CAS Number: 1000573-45-4

Molecular Formula: C6HFCl2Br2

N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine structure

N-(2-Methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]-beta-alanine

CAS Number: 103687-96-3

Molecular Formula: C17H19NO5S

5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine structure

5'-O-[Bis(4-methoxyphenyl)(phenyl)methyl]cytidine

CAS Number: 112897-99-1

Molecular Formula: C30H31N3O7

Darunavir-d9 structure

Darunavir-d9

CAS Number: 1133378-37-6

Molecular Formula: C27H28D9N3O7S

2-Bromo-3-isopropoxypyridine structure

2-Bromo-3-isopropoxypyridine

CAS Number: 113503-65-4

Molecular Formula: C8H10BrNO

Methyl 6-fluoro-4-oxo-4H-chromene-2-carboxylate structure

Methyl 6-fluoro-4-oxo-4H-chromene-2-carboxylate

CAS Number: 116543-91-0

Molecular Formula: C11H7FO4

(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile structure

(3S,4R)-3-Hydroxy-2,2-dimethyl-4-[(3-oxo-1-cyclopenten-1-yl)oxy]-6-chromanecarbonitrile

CAS Number: 121055-10-5

Molecular Formula: C17H17NO4

Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate structure

Methyl 5-chloropyrazolo[1,5-a]pyrimidine-2-carboxylate

CAS Number: 1263059-26-2

Molecular Formula: C8H6ClN3O2

8-Bromoisoquinolin-1-amine structure

8-Bromoisoquinolin-1-amine

CAS Number: 1337879-85-2

Molecular Formula: C9H7BrN2

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Supplier Information

Jin Jinle (Hunan) Chemical Co., Ltd.

CAS Number: 76-50-6

Mann's Group Limited

CAS Number: 76-50-6

CHEMOS GmbH & Co. KG

CAS Number: 76-50-6