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129747-33-7 | 1H-Imidazole, 1-[3-(chloromethyl)phenyl]-
CAS No: 129747-33-7 Catalog No: AG000TN0 MDL No:
Product Description
Catalog Number:
AG000TN0
Chemical Name:
1H-Imidazole, 1-[3-(chloromethyl)phenyl]-
CAS Number:
129747-33-7
Molecular Formula:
C10H9ClN2
Molecular Weight:
192.6449
IUPAC Name:
1-[3-(chloromethyl)phenyl]imidazole
InChI:
InChI=1S/C10H9ClN2/c11-7-9-2-1-3-10(6-9)13-5-4-12-8-13/h1-6,8H,7H2
InChI Key:
GBDOQRFQFRZGHV-UHFFFAOYSA-N
SMILES:
ClCc1cccc(c1)n1cncc1
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.045g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.646g/mol
Monoisotopic Mass:
192.045g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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