5-PHENYLPYRROLE-2-PROPIONIC ACID

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C13H13NO2
Molecular Weight	215.2478
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-PHENYLPYRROLE-2-PROPIONIC ACID

Structure Search

SMILES

OC(=O)CCC1=CC=C(N1)C2=CC=CC=C2

InChI

InChIKey=RSKVDNXGAFVGIU-UHFFFAOYSA-N

InChI=1S/C13H13NO2/c15-13(16)9-7-11-6-8-12(14-11)10-4-2-1-3-5-10/h1-6,8,14H,7,9H2,(H,15,16)

HIDE SMILES / InChI

Molecular Formula	C13H13NO2
Molecular Weight	215.2478
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 `Tue Apr 01 19:59:32 GMT 2025` Edited by `admin` on `Tue Apr 01 19:59:32 GMT 2025`
Record UNII	4Q5L9NX4R8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-75600

Preferred Name

English

5-PHENYLPYRROLE-2-PROPIONIC ACID

Systematic Name

English

3-(5-PHENYL-1H-PYRROL-2-YL)PROPANOIC ACID

Systematic Name

English

NCI 75600

Code

English

5-PHENYL-1H-PYRROLE-2-PROPANOIC ACID

Systematic Name

English

1H-PYRROLE-2-PROPANOIC ACID, 5-PHENYL-

Systematic Name

English

Code System Code Type Description

NSC

75600

Created by admin on Tue Apr 01 19:59:32 GMT 2025 , Edited by admin on Tue Apr 01 19:59:32 GMT 2025

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FDA UNII

4Q5L9NX4R8

Created by admin on Tue Apr 01 19:59:32 GMT 2025 , Edited by admin on Tue Apr 01 19:59:32 GMT 2025

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CAS

79720-70-0

Created by admin on Tue Apr 01 19:59:32 GMT 2025 , Edited by admin on Tue Apr 01 19:59:32 GMT 2025

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EPA CompTox

DTXSID30229848

Created by admin on Tue Apr 01 19:59:32 GMT 2025 , Edited by admin on Tue Apr 01 19:59:32 GMT 2025

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PUBCHEM

96467

Created by admin on Tue Apr 01 19:59:32 GMT 2025 , Edited by admin on Tue Apr 01 19:59:32 GMT 2025

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