3-Ethyl-3-heptanol

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C9H20O
Molecular Weight	144.2545
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-Ethyl-3-heptanol

Structure Search

SMILES

CCCCC(O)(CC)CC

InChI

InChIKey=XKRZDNKKANUBPV-UHFFFAOYSA-N

InChI=1S/C9H20O/c1-4-7-8-9(10,5-2)6-3/h10H,4-8H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C9H20O
Molecular Weight	144.2545
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 17:46:30 GMT 2025` Edited by `admin` on `Tue Apr 01 17:46:30 GMT 2025`
Record UNII	RM4GV9TV9Y
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3-Ethyl-3-heptanol

Systematic Name

English

3-Ethylheptan-3-ol

Preferred Name

English

AI3-24976

Code

English

NSC-96959

Code

English

3-Heptanol, 3-ethyl-

Systematic Name

English

Code System Code Type Description

NSC

96959

Created by admin on Tue Apr 01 17:46:30 GMT 2025 , Edited by admin on Tue Apr 01 17:46:30 GMT 2025

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EPA CompTox

DTXSID70173477

Created by admin on Tue Apr 01 17:46:30 GMT 2025 , Edited by admin on Tue Apr 01 17:46:30 GMT 2025

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ECHA (EC/EINECS)

243-301-4

Created by admin on Tue Apr 01 17:46:30 GMT 2025 , Edited by admin on Tue Apr 01 17:46:30 GMT 2025

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CAS

19780-41-7

Created by admin on Tue Apr 01 17:46:30 GMT 2025 , Edited by admin on Tue Apr 01 17:46:30 GMT 2025

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FDA UNII

RM4GV9TV9Y

Created by admin on Tue Apr 01 17:46:30 GMT 2025 , Edited by admin on Tue Apr 01 17:46:30 GMT 2025

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PUBCHEM

88241

Created by admin on Tue Apr 01 17:46:30 GMT 2025 , Edited by admin on Tue Apr 01 17:46:30 GMT 2025

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