632628-04-7
3,5-DIAMINO-2-METHYL-BENZOIC ACID, METHYL ESTER
Name3,5-DIAMINO-2-METHYL-BENZOIC ACID, METHYL ESTER
1Identification
【Name】
3,5-DIAMINO-2-METHYL-BENZOIC ACID, METHYL ESTER
【CAS】
【MDL】
MFCD12913598
【English Synonyms】
【Formula】
C9 H12 N2 O2
【MolWeight】
180.206
【Inchi】
InChI=1S/C9H12N2O2/c1-5-7(9(12)13-2)3-6(10)4-8(5)11/h3-4H,10-11H2,1-2H3
【InChIKey】
InChIKey=NMWNWXDDKRCUCS-UHFFFAOYSA-N
【SMILES】
Cc1c(cc(cc1N)N)C(=O)OC
【MOL File】
3,5-DIAMINO-2-METHYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,5-DIAMINO-2-METHYL-BENZOIC ACID, METHYL ESTER.cml