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19809-02-0

19809-02-0 | Ethanone, 1-[2-(chloromethyl)-1H-benzimidazol-1-yl]-

CAS No: 19809-02-0 Catalog No: AG002BAA MDL No:

Product Description

Catalog Number:
AG002BAA
Chemical Name:
Ethanone, 1-[2-(chloromethyl)-1H-benzimidazol-1-yl]-
CAS Number:
19809-02-0
Molecular Formula:
C10H9ClN2O
Molecular Weight:
208.6443
IUPAC Name:
1-[2-(chloromethyl)benzimidazol-1-yl]ethanone
InChI:
InChI=1S/C10H9ClN2O/c1-7(14)13-9-5-3-2-4-8(9)12-10(13)6-11/h2-5H,6H2,1H3
InChI Key:
XOAVRYNXKLYQMQ-UHFFFAOYSA-N
SMILES:
ClCc1nc2c(n1C(=O)C)cccc2
NSC Number:
106616

Properties

Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.04g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.645g/mol
Monoisotopic Mass:
208.04g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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