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82324-37-6 | 1H-Imidazo[2,1-c][1,2,4]triazepine(9CI)
CAS No: 82324-37-6 Catalog No: AG004YR2 MDL No:
Product Description
Catalog Number:
AG004YR2
Chemical Name:
1H-Imidazo[2,1-c][1,2,4]triazepine(9CI)
CAS Number:
82324-37-6
Molecular Formula:
C6H6N4
Molecular Weight:
134.1386
IUPAC Name:
1H-imidazo[2,1-c][1,2,4]triazepine
InChI:
InChI=1S/C6H6N4/c1-2-8-9-6-7-3-5-10(6)4-1/h1-5H,(H,7,9)
InChI Key:
SYGWVGVEBCHCNY-UHFFFAOYSA-N
SMILES:
c1ccn2c([nH]n1)ncc2
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.059g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
134.142g/mol
Monoisotopic Mass:
134.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
42.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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