3-METHYL-1-PENTYNE

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C6H10
Molecular Weight	82.1436
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-METHYL-1-PENTYNE

Structure Search

SMILES

CCC(C)C#C

InChI

InChIKey=PLHJCCHSCFNKCC-UHFFFAOYSA-N

InChI=1S/C6H10/c1-4-6(3)5-2/h1,6H,5H2,2-3H3

HIDE SMILES / InChI

Molecular Formula	C6H10
Molecular Weight	82.1436
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 `Wed Apr 02 11:03:52 GMT 2025` Edited by `admin` on `Wed Apr 02 11:03:52 GMT 2025`
Record UNII	33DA288VLR
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

NSC-134992

Preferred Name

English

3-METHYL-1-PENTYNE

Systematic Name

English

SEC-BUTYLACETYLENE

Common Name

English

1-PENTYNE, 3-METHYL-

Systematic Name

English

2-ETHYL-3-BUTYNE

Systematic Name

English

Code System Code Type Description

PUBCHEM

136704

Created by admin on Wed Apr 02 11:03:52 GMT 2025 , Edited by admin on Wed Apr 02 11:03:52 GMT 2025

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NSC

134992

Created by admin on Wed Apr 02 11:03:52 GMT 2025 , Edited by admin on Wed Apr 02 11:03:52 GMT 2025

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FDA UNII

33DA288VLR

Created by admin on Wed Apr 02 11:03:52 GMT 2025 , Edited by admin on Wed Apr 02 11:03:52 GMT 2025

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CAS

922-59-8

Created by admin on Wed Apr 02 11:03:52 GMT 2025 , Edited by admin on Wed Apr 02 11:03:52 GMT 2025

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EPA CompTox

DTXSID601350357

Created by admin on Wed Apr 02 11:03:52 GMT 2025 , Edited by admin on Wed Apr 02 11:03:52 GMT 2025

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