3-Pentylpentane-2,4-dione

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H18O2
Molecular Weight	170.2487
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-Pentylpentane-2,4-dione

Structure Search

SMILES

CCCCCC(C(C)=O)C(C)=O

InChI

InChIKey=RSYGAEISWXZUKM-UHFFFAOYSA-N

InChI=1S/C10H18O2/c1-4-5-6-7-10(8(2)11)9(3)12/h10H,4-7H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C10H18O2
Molecular Weight	170.2487
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 `Sat Dec 16 12:16:52 GMT 2023` Edited by `admin` on `Sat Dec 16 12:16:52 GMT 2023`
Record UNII	ZJL7NZY4GE
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

3-Pentylpentane-2,4-dione

Systematic Name

English

NSC-87949

Code

English

2,4-Pentanedione, 3-pentyl-

Systematic Name

English

AI3-19322

Code

English

3-Pentyl-2,4-pentanedione

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID10182245

Created by admin on Sat Dec 16 12:16:52 GMT 2023 , Edited by admin on Sat Dec 16 12:16:52 GMT 2023

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CAS

27970-50-9

Created by admin on Sat Dec 16 12:16:52 GMT 2023 , Edited by admin on Sat Dec 16 12:16:52 GMT 2023

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ECHA (EC/EINECS)

248-754-1

Created by admin on Sat Dec 16 12:16:52 GMT 2023 , Edited by admin on Sat Dec 16 12:16:52 GMT 2023

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PUBCHEM

98194

Created by admin on Sat Dec 16 12:16:52 GMT 2023 , Edited by admin on Sat Dec 16 12:16:52 GMT 2023

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NSC

87949

Created by admin on Sat Dec 16 12:16:52 GMT 2023 , Edited by admin on Sat Dec 16 12:16:52 GMT 2023

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FDA UNII

ZJL7NZY4GE

Created by admin on Sat Dec 16 12:16:52 GMT 2023 , Edited by admin on Sat Dec 16 12:16:52 GMT 2023

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