PROPYL ACETOACETATE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H12O3
Molecular Weight	144.1684
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PROPYL ACETOACETATE

Structure Search

SMILES

CCCOC(=O)CC(C)=O

InChI

InChIKey=DHGFMVMDBNLMKT-UHFFFAOYSA-N

InChI=1S/C7H12O3/c1-3-4-10-7(9)5-6(2)8/h3-5H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C7H12O3
Molecular Weight	144.1684
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 10:28:06 GMT 2025` Edited by `admin` on `Wed Apr 02 10:28:06 GMT 2025`
Record UNII	DHP3NNH2R6
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PROPYL ACETOACETATE

Systematic Name

English

NSC-42862

Preferred Name

English

BUTANOIC ACID, 3-OXO-, PROPYL ESTER

Systematic Name

English

PROPYL 3-OXOBUTANOATE

Systematic Name

English

N-PROPYL ACETOACETATE

Common Name

English

Code System Code Type Description

NSC

42862

Created by admin on Wed Apr 02 10:28:06 GMT 2025 , Edited by admin on Wed Apr 02 10:28:06 GMT 2025

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CAS

1779-60-8

Created by admin on Wed Apr 02 10:28:06 GMT 2025 , Edited by admin on Wed Apr 02 10:28:06 GMT 2025

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PUBCHEM

74507

Created by admin on Wed Apr 02 10:28:06 GMT 2025 , Edited by admin on Wed Apr 02 10:28:06 GMT 2025

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ECHA (EC/EINECS)

217-223-6

Created by admin on Wed Apr 02 10:28:06 GMT 2025 , Edited by admin on Wed Apr 02 10:28:06 GMT 2025

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EPA CompTox

DTXSID60170394

Created by admin on Wed Apr 02 10:28:06 GMT 2025 , Edited by admin on Wed Apr 02 10:28:06 GMT 2025

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FDA UNII

DHP3NNH2R6

Created by admin on Wed Apr 02 10:28:06 GMT 2025 , Edited by admin on Wed Apr 02 10:28:06 GMT 2025

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