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19276-03-0 | 1H-Imidazole, 2-(chloromethyl)-1-(phenylmethyl)-, hydrochloride (1:1)
CAS No: 19276-03-0 Catalog No: AG002GAG MDL No:MFCD00035210
Product Description
Catalog Number:
AG002GAG
Chemical Name:
1H-Imidazole, 2-(chloromethyl)-1-(phenylmethyl)-, hydrochloride (1:1)
CAS Number:
19276-03-0
Molecular Formula:
C11H12Cl2N2
Molecular Weight:
243.1324
MDL Number:
MFCD00035210
IUPAC Name:
1-benzyl-2-(chloromethyl)imidazole;hydrochloride
InChI:
InChI=1S/C11H11ClN2.ClH/c12-8-11-13-6-7-14(11)9-10-4-2-1-3-5-10;/h1-7H,8-9H2;1H
InChI Key:
IOOCHXMDSFPOGL-UHFFFAOYSA-N
SMILES:
ClCc1nccn1Cc1ccccc1.Cl
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.038g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
243.131g/mol
Monoisotopic Mass:
242.038g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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