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630120-23-9 | Pyridine, 1,2,3,6-tetrahydro-4-(1-methyl-1H-imidazol-2-yl)- (9CI)
CAS No: 630120-23-9 Catalog No: AG00F9DI MDL No:MFCD11899297
Product Description
Catalog Number:
AG00F9DI
Chemical Name:
Pyridine, 1,2,3,6-tetrahydro-4-(1-methyl-1H-imidazol-2-yl)- (9CI)
CAS Number:
630120-23-9
Molecular Formula:
C9H13N3
Molecular Weight:
163.2196
MDL Number:
MFCD11899297
IUPAC Name:
4-(1-methylimidazol-2-yl)-1,2,3,6-tetrahydropyridine
InChI:
InChI=1S/C9H13N3/c1-12-7-6-11-9(12)8-2-4-10-5-3-8/h2,6-7,10H,3-5H2,1H3
InChI Key:
NAGXQVCAQNMXDR-UHFFFAOYSA-N
SMILES:
Cn1ccnc1C1=CCNCC1
Properties
Complexity:
188
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.111g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
163.224g/mol
Monoisotopic Mass:
163.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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