2,2,4-TRIMETHYL-1-PENTANOL

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C8H18O
Molecular Weight	130.2279
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,2,4-TRIMETHYL-1-PENTANOL

Structure Search

SMILES

CC(C)CC(C)(C)CO

InChI

InChIKey=CWPPDTVYIJETDF-UHFFFAOYSA-N

InChI=1S/C8H18O/c1-7(2)5-8(3,4)6-9/h7,9H,5-6H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C8H18O
Molecular Weight	130.2279
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 18:12:54 GMT 2025` Edited by `admin` on `Tue Apr 01 18:12:54 GMT 2025`
Record UNII	IX60R7GK8R
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NSC-35410

Preferred Name

English

2,2,4-TRIMETHYL-1-PENTANOL

Systematic Name

English

1-PENTANOL, 2,2,4-TRIMETHYL-

Systematic Name

English

Code System Code Type Description

NSC

35410

Created by admin on Tue Apr 01 18:12:54 GMT 2025 , Edited by admin on Tue Apr 01 18:12:54 GMT 2025

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ECHA (EC/EINECS)

204-628-8

Created by admin on Tue Apr 01 18:12:54 GMT 2025 , Edited by admin on Tue Apr 01 18:12:54 GMT 2025

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CAS

123-44-4

Created by admin on Tue Apr 01 18:12:54 GMT 2025 , Edited by admin on Tue Apr 01 18:12:54 GMT 2025

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FDA UNII

IX60R7GK8R

Created by admin on Tue Apr 01 18:12:54 GMT 2025 , Edited by admin on Tue Apr 01 18:12:54 GMT 2025

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PUBCHEM

31258

Created by admin on Tue Apr 01 18:12:54 GMT 2025 , Edited by admin on Tue Apr 01 18:12:54 GMT 2025

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EPA CompTox

DTXSID6073158

Created by admin on Tue Apr 01 18:12:54 GMT 2025 , Edited by admin on Tue Apr 01 18:12:54 GMT 2025

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