4-[(ISOBUTYRYLAMINO)METHYL]BENZOIC ACID

CAS No.
908495-37-4
CCD No.
CCD00671701
Formula
C12 H15 N O3
MolWeight
221.255

Basic Information

Product Name: 4-[(ISOBUTYRYLAMINO)METHYL]BENZOIC ACID
CAS: 908495-37-4
English Synonyms: 4-[(2-METHYLPROPANAMIDO)METHYL]BENZOIC ACID ; 4-([(2-METHYLPROPANOYL)AMINO]METHYL)BENZOIC ACID ; 4-[(ISOBUTYRYLAMINO)METHYL]BENZOIC ACID
MDL Number.: MFCD08593372
H bond acceptor: 4
H bond donor: 2
Smile: CC(C)C(=O)NCc1ccc(cc1)C(=O)O
InChi: InChI=1S/C12H15NO3/c1-8(2)11(14)13-7-9-3-5-10(6-4-9)12(15)16/h3-6,8H,7H2,1-2H3,(H,13,14)(H,15,16)
InChiKey: InChIKey=RMFFHXZHRXYKDW-UHFFFAOYSA-N

Property

Comments: WARNINGS: IRRITANT

Safety information

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