(4aR,10bR)-4-Propyl-3,4,4a,10b-tetrahydro-2H,5H-chromeno[4,3-b][1,4]oxazin-9-ol hydrochloride (1:1)

Basic Information

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CAS Number

300576-59-4

Molecular Formula

C14H20ClNO3

Molecular Weight

285.77 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

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

389°C at 760 mmHg

Density

1.165

Flash Point

189°C

Solubility

ethanol: >10mg/mL

Refractive Index

1.551

SMILES

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CCCN1CCOC2C1COC3=C2C=C(C=C3)O.Cl

InChI

InChI=1S/C14H19NO3.ClH/c1-2-5-15-6-7-17-14-11-8-10(16)3-4-13(11)18-9-12(14)15;/h3-4,8,12,14,16H,2,5-7,9H2,1H3;1H/t12-,14-;/m1./s1

InChIKey

DCFXOTRONMKUJB-QMDUSEKHSA-N

LogP

2.3583000000000016

Topological Polar Surface Area

41.93000000000001 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

286

Synonyms & References

English

(+)-PD 128970 HCl
(+)-PD 128907 hydrochloride
MLS002153393
P-216
rel-(4aR,10bR)-4-Propyl-2,3,4,4a,5,10b-hexahydrochromeno[4,3-b][1,4]oxazin-9-ol hydrochloride
(+)-(4aR,10bR)-3,4,4a,10b-Tetrahydro-4-propyl-2H,5H-[1]benzopyrano[4,3-b]-1,4-oxazin-9-ol hydrochloride
O12068
SPD-128907
PD128907Hydrochloride
(+/-)-PD 128,907 hydrochloride, solid, >=98% (HPLC)
PD128907 Hydrochloride
LP01038
SMR001230774
(4aR,10bR)-4-propyl-3,4a,5,10b-tetrahydro-2H-chromeno[4,3-b][1,4]oxazin-9-ol, hydrochloride
EU-0100988
2H,5H-[1]Benzopyrano[4,3-b]-1,4-oxazin-9-ol,3,4,4a,10b-tetrahydro-4-propyl-, hydrochloride (1:1), (4aR,10bR)-rel-
112960-16-4
LP00988
HY-110000
(+)-PD128907 hydrochloride
PD125530
pd 128907 hcl
(+)-PD 128,907 hydrochloride
( inverted question mark)-PD 128,907 hydrochloride
J-017752
(4aR,10bR)-4-Propyl-3,4,4a,10b-tetrahydro-2H,5H-chromeno[4,3-b][1,4]oxazin-9-ol hydrochloride
SR-01000075396-1
D83189
DTXSID601017395
DS-8408
(+/-)-PD128907 hydrochloride

MDL Number

MFCD00210210

FAQ

What is (4aR,10bR)-4-Propyl-3,4,4a,10b-tetrahydro-2H,5H-chromeno[4,3-b][1,4]oxazin-9-ol hydrochloride (CAS: 300576-59-4)?

(4aR,10bR)-4-Propyl-3,4,4a,10b-tetrahydro-2H,5H-chromeno[4,3-b][1,4]oxazin-9-ol hydrochloride is a chemical compound with the CAS number 300576-59-4. It is a white or off-white crystalline solid with a molecular weight of approximately 351.38 g/mol. This compound features a chromene and oxazin ring system. It is insoluble in water but soluble in organic solvents such as ethanol and dichloromethane.

What are the main uses of (4aR,10bR)-4-Propyl-3,4,4a,10b-tetrahydro-2H,5H-chromeno[4,3-b][1,4]oxazin-9-ol hydrochloride (CAS: 300576-59-4)?

(4aR,10bR)-4-Propyl-3,4,4a,10b-tetrahydro-2H,5H-chromeno[4,3-b][1,4]oxazin-9-ol hydrochloride is primarily used in pharmaceuticals for its potential as a prodrug. It may also find applications in research, particularly in studies related to bioavailability and pharmacokinetics. Its use in industrial applications is limited but may be explored for specific chemical synthesis purposes.

Is (4aR,10bR)-4-Propyl-3,4,4a,10b-tetrahydro-2H,5H-chromeno[4,3-b][1,4]oxazin-9-ol hydrochloride (CAS: 300576-59-4) safe?

(4aR,10bR)-4-Propyl-3,4,4a,10b-tetrahydro-2H,5H-chromeno[4,3-b][1,4]oxazin-9-ol hydrochloride is generally considered safe when handled with proper precautions. However, direct contact with the skin or inhalation of dust should be avoided. Protective measures include the use of gloves, goggles, and a fume hood during handling. It is important to follow all safety guidelines provided by the manufacturer.

How should (4aR,10bR)-4-Propyl-3,4,4a,10b-tetrahydro-2H,5H-chromeno[4,3-b][1,4]oxazin-9-ol hydrochloride (CAS: 300576-59-4) be stored?

(4aR,10bR)-4-Propyl-3,4,4a,10b-tetrahydro-2H,5H-chromeno[4,3-b][1,4]oxazin-9-ol hydrochloride should be stored in a cool, dry place away from direct sunlight. It should be kept in a tightly sealed container to prevent moisture and light exposure. The storage temperature should not exceed 25°C. Avoid storing in areas with high humidity to prevent degradation of the compound.