19623-23-5
QUINAZOLINE, 1,5,6,7,8,8A-HEXAHYDRO-2-AMINO-4-METHYL-, MONOACETATE
NameQUINAZOLINE, 1,5,6,7,8,8A-HEXAHYDRO-2-AMINO-4-METHYL-, MONOACETATE
FormulaC9 H15 N3 . C2 H4 O2
1Identification
【Name】
QUINAZOLINE, 1,5,6,7,8,8A-HEXAHYDRO-2-AMINO-4-METHYL-, MONOACETATE
【CAS】
【MDL】
MFCD01686615
【English Synonyms】
【Formula】
C9 H15 N3 . C2 H4 O2
【MolWeight】
225.29
【Inchi】
InChI=1S/C9H15N3.C2H4O2/c1-6-7-4-2-3-5-8(7)12-9(10)11-6;1-2(3)4/h8H,2-5H2,1H3,(H3,10,11,12);1H3,(H,3,4)
【InChIKey】
InChIKey=VAOVFYFZTSFDHJ-UHFFFAOYSA-N
【SMILES】
CC1=C2CCCCC2NC(=N1)N.CC(=O)O
【MOL File】
QUINAZOLINE, 1,5,6,7….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
QUINAZOLINE, 1,5,6,7,8,8A-HEXAHYDRO-2-AMINO-4-METHYL-, MONOACETATE.cml