635706-07-9
(3-AMINO-6-HYDROXYMETHYL-2-OXO-2,3,4,7-TETRAHYDRO-AZEPIN-1-YL)-ACETIC ACID METHYL ESTER
Name(3-AMINO-6-HYDROXYMETHYL-2-OXO-2,3,4,7-TETRAHYDRO-AZEPIN-1-YL)-ACETIC ACID METHYL ESTER
1Identification
【Name】
(3-AMINO-6-HYDROXYMETHYL-2-OXO-2,3,4,7-TETRAHYDRO-AZEPIN-1-YL)-ACETIC ACID METHYL ESTER
【CAS】
【MDL】
MFCD18073419
【English Synonyms】
【Formula】
C10 H16 N2 O4
【MolWeight】
228.246
【Inchi】
InChI=1S/C10H16N2O4/c1-16-9(14)5-12-4-7(6-13)2-3-8(11)10(12)15/h2,8,13H,3-6,11H2,1H3
【InChIKey】
InChIKey=IECSXAHYGKIHSL-UHFFFAOYSA-N
【SMILES】
COC(=O)CN1CC(=CCC(C1=O)N)CO
【MOL File】
(3-AMINO-6-HYDROXYME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:-1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(3-AMINO-6-HYDROXYMETHYL-2-OXO-2,3,4,7-TETRAHYDRO-AZEPIN-1-YL)-ACETIC ACID METHYL ESTER.cml