3,3-DIMETHYL-1-PENTYNE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H12
Molecular Weight	96.1702
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3,3-DIMETHYL-1-PENTYNE

Structure Search

SMILES

CCC(C)(C)C#C

InChI

InChIKey=KQIIKSQUHGGYCU-UHFFFAOYSA-N

InChI=1S/C7H12/c1-5-7(3,4)6-2/h1H,6H2,2-4H3

HIDE SMILES / InChI

Molecular Formula	C7H12
Molecular Weight	96.1702
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 `Wed Apr 02 15:02:01 GMT 2025` Edited by `admin` on `Wed Apr 02 15:02:01 GMT 2025`
Record UNII	4A5U8NFC43
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-211470

Preferred Name

English

3,3-DIMETHYL-1-PENTYNE

Systematic Name

English

1-PENTYNE, 3,3-DIMETHYL-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID20309249

Created by admin on Wed Apr 02 15:02:01 GMT 2025 , Edited by admin on Wed Apr 02 15:02:01 GMT 2025

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FDA UNII

4A5U8NFC43

Created by admin on Wed Apr 02 15:02:01 GMT 2025 , Edited by admin on Wed Apr 02 15:02:01 GMT 2025

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PUBCHEM

309266

Created by admin on Wed Apr 02 15:02:01 GMT 2025 , Edited by admin on Wed Apr 02 15:02:01 GMT 2025

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CAS

918-82-1

Created by admin on Wed Apr 02 15:02:01 GMT 2025 , Edited by admin on Wed Apr 02 15:02:01 GMT 2025

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NSC

211470

Created by admin on Wed Apr 02 15:02:01 GMT 2025 , Edited by admin on Wed Apr 02 15:02:01 GMT 2025

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