2-chloromethyl-4-phenyl-1H-benzimidazole

HCID 22018618
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Basic information

CAS
405173-86-6
Standard SMILES
ClCc1nc2c(-c3ccccc3)cccc2[nH]1
InChIKey
DWOFMVXJTCDMIL-UHFFFAOYSA-N
Molecular formula
C14H11ClN2
Average molar mass
242.7 g/mol
Monoisotopic mass
242.06107603

Names & identifiers

Preferred name
2-chloromethyl-4-phenyl-1H-benzimidazole
IUPAC
2-(chloromethyl)-4-phenyl-1H-benzimidazole

Names & synonyms

2-chloromethyl-4-phenyl-1H-benzimidazoleSCHEMBL4066174DWOFMVXJTCDMIL-UHFFFAOYSA-NDTXSID101265804405173-86-62-(Chloromethyl)-7-phenyl-1H-benzimidazole

Database identifiers

CAS
405173-86-6
PubChem CID
22018618
DTXSID
DTXSID101265804

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
28.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
17

Related reactions

3 records
New reaction record

Compound notes

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