3,5-DIMETHYL-1-HEXYN-3-OL

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C8H14O
Molecular Weight	126.1962
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,5-DIMETHYL-1-HEXYN-3-OL

Structure Search

SMILES

CC(C)CC(C)(O)C#C

InChI

InChIKey=NECRQCBKTGZNMH-UHFFFAOYSA-N

InChI=1S/C8H14O/c1-5-8(4,9)6-7(2)3/h1,7,9H,6H2,2-4H3

HIDE SMILES / InChI

Molecular Formula	C8H14O
Molecular Weight	126.1962
Charge	0
Count

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

Approval Year

Patents

Patents

Substance Class	Chemical Created by `admin` on `Mon Mar 31 18:36:20 GMT 2025` Edited by `admin` on `Mon Mar 31 18:36:20 GMT 2025`
Record UNII	Q988C9BDWK
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3,5-DIMETHYL-1-HEXYN-3-OL

Systematic Name

English

SURFYNOL 61

Preferred Name

English

HEXYNOL, DIMETHYL-

Systematic Name

English

DIMETHYLHEXYNOL

Systematic Name

English

1-HEXYN-3-OL, 3,5-DIMETHYL-

Systematic Name

English

DIMETHYL HEXYNOL

Systematic Name

English

3,5-DIMETHYLHEXYN-3-OL

Systematic Name

English

NSC-978

Code

English

Code System Code Type Description

CAS

107-54-0

Created by admin on Mon Mar 31 18:36:20 GMT 2025 , Edited by admin on Mon Mar 31 18:36:20 GMT 2025

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FDA UNII

Q988C9BDWK

Created by admin on Mon Mar 31 18:36:20 GMT 2025 , Edited by admin on Mon Mar 31 18:36:20 GMT 2025

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NSC

978

Created by admin on Mon Mar 31 18:36:20 GMT 2025 , Edited by admin on Mon Mar 31 18:36:20 GMT 2025

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PUBCHEM

61018

Created by admin on Mon Mar 31 18:36:20 GMT 2025 , Edited by admin on Mon Mar 31 18:36:20 GMT 2025

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CAS

1321-33-1

Created by admin on Mon Mar 31 18:36:20 GMT 2025 , Edited by admin on Mon Mar 31 18:36:20 GMT 2025

ALTERNATIVE

ECHA (EC/EINECS)

203-500-9

Created by admin on Mon Mar 31 18:36:20 GMT 2025 , Edited by admin on Mon Mar 31 18:36:20 GMT 2025

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EPA CompTox

DTXSID6041472

Created by admin on Mon Mar 31 18:36:20 GMT 2025 , Edited by admin on Mon Mar 31 18:36:20 GMT 2025

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