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75100-51-5 | 1H-Pyrrolo[3,2-b]pyridine,2-(1-methylethyl)-(9CI)
CAS No: 75100-51-5 Catalog No: AG00GECO MDL No:MFCD18802726
Product Description
Catalog Number:
AG00GECO
Chemical Name:
1H-Pyrrolo[3,2-b]pyridine,2-(1-methylethyl)-(9CI)
CAS Number:
75100-51-5
Molecular Formula:
C10H12N2
Molecular Weight:
160.2157
MDL Number:
MFCD18802726
IUPAC Name:
2-propan-2-yl-1H-pyrrolo[3,2-b]pyridine
InChI:
InChI=1S/C10H12N2/c1-7(2)9-6-10-8(12-9)4-3-5-11-10/h3-7,12H,1-2H3
InChI Key:
OKEHFANNANVSEO-UHFFFAOYSA-N
SMILES:
CC(c1cc2c([nH]1)cccn2)C
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.1g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
160.22g/mol
Monoisotopic Mass:
160.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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