1-ETHYL-1-METHYL-3-PHENYLPROPYL ACETATE

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C14H20O2
Molecular Weight	220.3074
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-ETHYL-1-METHYL-3-PHENYLPROPYL ACETATE

Structure Search

SMILES

CCC(C)(CCC1=CC=CC=C1)OC(C)=O

InChI

InChIKey=HIWRBTFSEFIZNE-UHFFFAOYSA-N

InChI=1S/C14H20O2/c1-4-14(3,16-12(2)15)11-10-13-8-6-5-7-9-13/h5-9H,4,10-11H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C14H20O2
Molecular Weight	220.3074
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:30:49 GMT 2023` Edited by `admin` on `Sat Dec 16 09:30:49 GMT 2023`
Record UNII	OX1DN3B7LS
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-ETHYL-1-METHYL-3-PHENYLPROPYL ACETATE

Systematic Name

English

1-PHENYL-3-METHYL-3-PENTANYL ACETATE

Systematic Name

English

BENZENEPROPANOL, .ALPHA.-ETHYL-.ALPHA.-METHYL-, 1-ACETATE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID10888033

Created by admin on Sat Dec 16 09:30:49 GMT 2023 , Edited by admin on Sat Dec 16 09:30:49 GMT 2023

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CAS

72007-81-9

Created by admin on Sat Dec 16 09:30:49 GMT 2023 , Edited by admin on Sat Dec 16 09:30:49 GMT 2023

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ECHA (EC/EINECS)

276-282-6

Created by admin on Sat Dec 16 09:30:49 GMT 2023 , Edited by admin on Sat Dec 16 09:30:49 GMT 2023

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FDA UNII

OX1DN3B7LS

Created by admin on Sat Dec 16 09:30:49 GMT 2023 , Edited by admin on Sat Dec 16 09:30:49 GMT 2023

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PUBCHEM

160065

Created by admin on Sat Dec 16 09:30:49 GMT 2023 , Edited by admin on Sat Dec 16 09:30:49 GMT 2023

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