635705-94-1
(3-AMINO-2-OXO-2,3,4,7-TETRAHYDRO-AZEPIN-1-YL)-ACETIC ACID METHYL ESTER
Name(3-AMINO-2-OXO-2,3,4,7-TETRAHYDRO-AZEPIN-1-YL)-ACETIC ACID METHYL ESTER
1Identification
【Name】
(3-AMINO-2-OXO-2,3,4,7-TETRAHYDRO-AZEPIN-1-YL)-ACETIC ACID METHYL ESTER
【CAS】
【MDL】
MFCD18073403
【English Synonyms】
【Formula】
C9 H14 N2 O3
【MolWeight】
198.221
【Inchi】
InChI=1S/C9H14N2O3/c1-14-8(12)6-11-5-3-2-4-7(10)9(11)13/h2-3,7H,4-6,10H2,1H3
【InChIKey】
InChIKey=IATUSMWPTLNHQO-UHFFFAOYSA-N
【SMILES】
COC(=O)CN1CC=CCC(C1=O)N
【MOL File】
(3-AMINO-2-OXO-2,3,4….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(3-AMINO-2-OXO-2,3,4,7-TETRAHYDRO-AZEPIN-1-YL)-ACETIC ACID METHYL ESTER.cml