Benzimidazole, 2-chloromethyl-5,6-dichloro-

HCID 38349
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Basic information

CAS
39811-03-5
Standard SMILES
ClCc1nc2cc(Cl)c(Cl)cc2[nH]1
InChIKey
IUNRBKGPVGKLNG-UHFFFAOYSA-N
Molecular formula
C8H5Cl3N2
Average molar mass
235.5 g/mol
Monoisotopic mass
233.9518312

Names & identifiers

Preferred name
Benzimidazole, 2-chloromethyl-5,6-dichloro-
IUPAC
5,6-dichloro-2-(chloromethyl)-1H-benzimidazole
English name
5,6-Dichloro-2-(chloromethyl)-1H-benzimidazole
Molecular formula
C8H5Cl3N2
Molecular weight
235.5

Names & synonyms

39811-03-5BRN 0151313BENZIMIDAZOLE, 2-CHLOROMETHYL-5,6-DICHLORO-2-Chloromethyl-5,6-dichlorobenzimidazoleDTXSID601928794-23-00-01123 (Beilstein Handbook Reference)RefChem:325875DTXCID501153705,6-dichloro-2-(chloromethyl)-1H-benzimidazole5,6-Dichloro-2-(chloromethyl)-1H-benzo[d]imidazoleMFCD016584535,6-dichloro-2-(chloromethyl)-1H-1,3-benzodiazole
Show more names
1H-Benzimidazole, 5,6-dichloro-2-(chloromethyl)-
5,6-dichloro-2-chloromethyl-1H-benzoimidazoleC8H5Cl3N2SCHEMBL486213IUNRBKGPVGKLNG-UHFFFAOYSA-NAKOS017919498AS-85222- chloromethyl-5,6-dichlorobenzimidazoleDB-358677

Database identifiers

CAS
39811-03-5
PubChem CID
38349
DTXSID
DTXSID60192879
Nikkaji
J69.197F

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
28.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
13

Physicochemical properties

Boiling point
437.2 · 437.2±35.0 °C(Predicted)
Density
1.605 · 1.605±0.06 g/cm3(Predicted)
pka
9.15 · 9.15±0.10(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning
Hazard statements
302 · H302-H315-H319-H335

Safety & regulation

Safety data

hs_code
2933998090
Signal word
Warning
Symbol(GHS)
GHS07
Hazard statements
H302-H315-H319-H335
Precautionary statements
P280-P305+P351+P338

Chemistry & industry

Suppliers4 total

常州合晶化工有限公司85528066 13775048983 · [email protected]
成都安普生医药科技有限公司13568817957 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]

Related reactions

3 records
New reaction record

Compound notes

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