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89730-94-9 | 6,7-Indolizinedicarbonitrile, 1,2,3,5-tetrahydro-5-imino-2,2-dimethyl-
CAS No: 89730-94-9 Catalog No: AG0041XE MDL No:
Product Description
Catalog Number:
AG0041XE
Chemical Name:
6,7-Indolizinedicarbonitrile, 1,2,3,5-tetrahydro-5-imino-2,2-dimethyl-
CAS Number:
89730-94-9
Molecular Formula:
C12H12N4
Molecular Weight:
212.2505
IUPAC Name:
5-imino-2,2-dimethyl-1,3-dihydroindolizine-6,7-dicarbonitrile
InChI:
InChI=1S/C12H12N4/c1-12(2)4-9-3-8(5-13)10(6-14)11(15)16(9)7-12/h3,15H,4,7H2,1-2H3
InChI Key:
YPCQZUBVFVJHBC-UHFFFAOYSA-N
SMILES:
N#Cc1cc2CC(Cn2c(=N)c1C#N)(C)C
Properties
Complexity:
530
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.106g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.256g/mol
Monoisotopic Mass:
212.106g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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