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88366-08-9 | 1H-1,2-Diazepine, 1-acetyl-6,7-dihydro-5-methyl-
CAS No: 88366-08-9 Catalog No: AG004J3U MDL No:
Product Description
Catalog Number:
AG004J3U
Chemical Name:
1H-1,2-Diazepine, 1-acetyl-6,7-dihydro-5-methyl-
CAS Number:
88366-08-9
Molecular Formula:
C8H12N2O
Molecular Weight:
152.1937
IUPAC Name:
1-(5-methyl-3,4-dihydrodiazepin-2-yl)ethanone
InChI:
InChI=1S/C8H12N2O/c1-7-3-5-9-10(6-4-7)8(2)11/h3,5H,4,6H2,1-2H3
InChI Key:
WIDUKPFAOLOLRH-UHFFFAOYSA-N
SMILES:
CC1=CC=NN(CC1)C(=O)C
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.095g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.197g/mol
Monoisotopic Mass:
152.095g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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