HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

4-chloro-2-phenyl-1H-benzimidazole

HCID 834883
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
71635-98-8
Standard SMILES
Clc1cccc2[nH]c(-c3ccccc3)nc12
InChIKey
QCPLGVDMLXCVCP-UHFFFAOYSA-N
Molecular formula
C13H9ClN2
Average molar mass
228.67 g/mol
Monoisotopic mass
228.045426

Names & identifiers

Preferred name
4-chloro-2-phenyl-1H-benzimidazole
IUPAC
4-chloro-2-phenyl-1H-benzimidazole
English name
1H-Benzimidazole, 4-chloro-2-phenyl-
Molecular formula
C13H9ClN2
Molecular weight
228.67696

Names & synonyms

4-chloro-2-phenyl-1H-benzimidazole71635-98-8DTXSID80356835RefChem:291567DTXCID503078941H-Benzimidazole, 4-chloro-2-phenyl-chlorophenyl benzo[d]imidazolSCHEMBL27961298SCHEMBL279612997-chloro-2-phenyl-1H-benzimidazoleSTL353594AKOS000299080
Show more names
4(7)-chloro-2-phenylbenzimidazole
AKOS0006353984-Chloro-2-phenyl-1H-1,3-benzimidazoleSR-01000389461SR-01000389461-1

Database identifiers

CAS
71635-98-8
PubChem CID
834883
DTXSID
DTXSID80356835
Nikkaji
J1.105.416A

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
28.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
16
Formal charge
0
Complexity
240

Chemistry & industry

Suppliers4 total

江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
河南利恩化工产品有限公司0371-63357898 15378766539 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
武汉万鉴生物科技有限公司13277087647 · [email protected]

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes