CAS
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3-[(Anilinocarbonyl)amino]propanoic acid
Catalog Number
ACMA00000873
Category
Amines
Molecular Weight
208.21
Molecular Formula
C10H12ClN
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Specification
Hazard Statements
H319
RIDADR
NONH for all modes of transport
Symbol
GHS07
What is the molecular formula of the compound with PubChem CID 258348?
The molecular formula is C10H12N2O3.
When was the compound first created and last modified in PubChem?
It was first created on 2005-03-26 and last modified on 2023-12-02.
What is the IUPAC name of the compound?
The IUPAC name is 3-(phenylcarbamoylamino)propanoic acid.
What is the InChI representation of the compound?
The InChI representation is InChI=1S/C10H12N2O3/c13-9(14)6-7-11-10(15)12-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,13,14)(H2,11,12,15).
What is the InChIKey of the compound?
The InChIKey is IYVODFJSPSNFKO-UHFFFAOYSA-N.
How many hydrogen bond donor counts does the compound have?
The compound has 3 hydrogen bond donor counts.
What is the topological polar surface area of the compound?
The topological polar surface area is 78.4 Ų.
Does the compound have any defined atom stereocenter count?
No, the compound does not have any defined atom stereocenter count.
What is the molecular weight of the compound?
The molecular weight is 208.21 g/mol.
Is the compound canonicalized in PubChem?
Yes, the compound is canonicalized in PubChem.
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