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1-(3,3-Dimethylcyclohexyl)ethyl 2-(1-oxopropoxy)acetate

1-(3,3-Dimethylcyclohexyl)ethyl 2-(1-oxopropoxy)acetate structure

CAS No:
236391-76-7
Formula:
C15H26O4
Chemical Name:
1-(3,3-Dimethylcyclohexyl)ethyl 2-(1-oxopropoxy)acetate
Synonyms:
Acetic acid,2-(1-oxopropoxy)-,1-(3,3-dimethylcyclohexyl)ethyl ester;Acetic acid,(1-oxopropoxy)-,1-(3,3-dimethylcyclohexyl)ethyl ester;1-(3,3-Dimethylcyclohexyl)ethyl 2-(1-oxopropoxy)acetate;Romandolide
Categories:
Flavors and Fragrances > Synthetic Fragrances

Description

musk methyl propionate is a colorless liquid with a soft but tenacious musky note resembling that of benzopyran musks.
The material can be prepared by reaction of ??,3,3-trimethylcyclohexane- 1-methanol with the corresponding acid chloride, that is, (2-chloro-2-oxo-ethyl) propanoate. It is used as a substantive musk note in fine fragrances and in perfumes for shampoos, fabric softeners, and so on.

1-(3,3-Dimethylcyclohexyl)ethyl 2-(1-oxopropoxy)acetate Basic Attributes

Molecular Weight：

271.37248

Exact Mass：

270.36

EC Number：

431-700-8

DSSTox ID：

DTXSID0051360

Characteristics

PSA：

52.6

XLogP3：

Density：

1.001±0.06 g/cm3(Predicted)

Safety Information

Precautionary statement(s)：

P273, P391, P501

Hazard Statements：

H411

1-(3,3-Dimethylcyclohexyl)ethyl 2-(1-oxopropoxy)acetate Use and Manufacturing

Manufacturing Info：

Acetic acid, 2-(1-oxopropoxy)-, 1-(3,3-dimethylcyclohexyl)ethyl ester: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Computed Properties

Molecular Weight:270.36
XLogP3:4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:270.18310931
Monoisotopic Mass:270.18310931
Topological Polar Surface Area:52.6
Heavy Atom Count:19
Complexity:322
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(3,3-Dimethylcyclohexyl)ethyl 2-(1-oxopropoxy)acetate

Description
Basic Attributes
Characteristics
Safety Information
Use and Manufacturing
Computed Properties
Learn More Other Chemicals

1-(3,3-Dimethylcyclohexyl)ethyl 2-(1-oxopropoxy)acetate

SDS

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