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190199-99-6 | 1H-Imidazole, 1-[2-(bromomethyl)phenyl]-, hydrobromide (1:1)
CAS No: 190199-99-6 Catalog No: AG002EEN MDL No:
Product Description
Catalog Number:
AG002EEN
Chemical Name:
1H-Imidazole, 1-[2-(bromomethyl)phenyl]-, hydrobromide (1:1)
CAS Number:
190199-99-6
Molecular Formula:
C10H10Br2N2
Molecular Weight:
318.0078
IUPAC Name:
1-[2-(bromomethyl)phenyl]imidazole;hydrobromide
InChI:
InChI=1S/C10H9BrN2.BrH/c11-7-9-3-1-2-4-10(9)13-6-5-12-8-13;/h1-6,8H,7H2;1H
InChI Key:
XZRNGRGXTRZMQM-UHFFFAOYSA-N
SMILES:
BrCc1ccccc1n1cncc1.Br
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.919g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
318.012g/mol
Monoisotopic Mass:
315.921g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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