6-bromo-2-[(Z)-2-chloroprop-1-enyl]-1H-benzimidazole

C10H8BrClN2 — CID 59008040

IUPAC6-bromo-2-[(Z)-2-chloroprop-1-enyl]-1H-benzimidazole
SMILESC/C(Cl)=C/c1nc2ccc(Br)cc2[nH]1
InChIInChI=1S/C10H8BrClN2/c1-6(12)4-10-13-8-3-2-7(11)5-9(8)14-10/h2-5H,1H3,(H,13,14)/b6-4-
InChIKeyUSUJYSKWFSWNKA-XQRVVYSFSA-N
MW271.55 g/mol
LogP3.92
Rot. Bonds1

About 6-bromo-2-[(Z)-2-chloroprop-1-enyl]-1H-benzimidazole

6-bromo-2-[(Z)-2-chloroprop-1-enyl]-1H-benzimidazole (PubChem CID 59008040) has the molecular formula C10H8BrClN2 and a molecular weight of 271.55 g/mol. Its IUPAC name is 6-bromo-2-[(Z)-2-chloroprop-1-enyl]-1H-benzimidazole.

Molecular Properties

Compound Name6-bromo-2-[(Z)-2-chloroprop-1-enyl]-1H-benzimidazole
PubChem CID59008040
Molecular FormulaC10H8BrClN2
Molecular Weight271.55 g/mol
Exact Mass269.96
IUPAC Name6-bromo-2-[(Z)-2-chloroprop-1-enyl]-1H-benzimidazole
SMILESC/C(Cl)=C/c1nc2ccc(Br)cc2[nH]1
InChIInChI=1S/C10H8BrClN2/c1-6(12)4-10-13-8-3-2-7(11)5-9(8)14-10/h2-5H,1H3,(H,13,14)/b6-4-
InChIKeyUSUJYSKWFSWNKA-XQRVVYSFSA-N
XLogP3.92
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.55
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-bromo-2-[(Z)-2-chloroprop-1-enyl]-1H-benzimidazole;ethane
CID 91546288
6-bromo-2-[(Z)-2-chloro-2-phenylethenyl]-1H-benzimidazole
CID 87293067
6-bromo-2-[(E)-2-(4-methylphenyl)ethenyl]-1H-benzimidazole
CID 15422407
6-bromo-2-[(E)-2-phenylethenyl]-1H-benzimidazole;ethane
CID 91356602
6-bromo-2-(1-chloroethyl)-1H-benzimidazole
CID 47003349
6-bromo-2-(chloromethyl)-1H-benzimidazole;dihydrochloride
CID 154729465
6-bromo-2-(1-chloroethyl)-1H-benzimidazole;hydrochloride
CID 47003348
6-bromo-2-[bromo(difluoro)methyl]-1H-benzimidazole
CID 119085035
6-bromo-2-[2-[4-(trifluoromethoxy)phenyl]ethenyl]-1H-benzimidazole
CID 67165368
3-(6-bromo-1H-benzimidazol-2-yl)propan-1-ol
CID 4162826
N-[(6-bromo-1H-benzimidazol-2-yl)methyl]propan-2-amine
CID 60837050
(E)-3-(6-bromo-1H-benzimidazol-2-yl)-1-(1,3,4-oxadiazol-2-yl)prop-2-en-1-one
CID 172638252

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-[(Z)-2-chloroprop-1-enyl]-1H-benzimidazole?
The IUPAC name of 6-bromo-2-[(Z)-2-chloroprop-1-enyl]-1H-benzimidazole (CID 59008040) is 6-bromo-2-[(Z)-2-chloroprop-1-enyl]-1H-benzimidazole.
What is the SMILES notation for 6-bromo-2-[(Z)-2-chloroprop-1-enyl]-1H-benzimidazole?
The canonical SMILES for 6-bromo-2-[(Z)-2-chloroprop-1-enyl]-1H-benzimidazole is C/C(Cl)=C/c1nc2ccc(Br)cc2[nH]1.
What is the InChIKey of 6-bromo-2-[(Z)-2-chloroprop-1-enyl]-1H-benzimidazole?
The InChIKey is USUJYSKWFSWNKA-XQRVVYSFSA-N. The full InChI is InChI=1S/C10H8BrClN2/c1-6(12)4-10-13-8-3-2-7(11)5-9(8)14-10/h2-5H,1H3,(H,13,14)/b6-4-.
What are the key properties of 6-bromo-2-[(Z)-2-chloroprop-1-enyl]-1H-benzimidazole?
6-bromo-2-[(Z)-2-chloroprop-1-enyl]-1H-benzimidazole has a molecular weight of 271.55 g/mol, XLogP of 3.92, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-[(Z)-2-chloroprop-1-enyl]-1H-benzimidazole is sourced from PubChem (CID 59008040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).