Chlormidazole hydrochloride

CAT: 0926-ZCA29863-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0926-ZCA29863-01Size:250 mg

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CAS Number

74298-63-8

Smiles

CC1=NC2=CC=CC=C2N1CC3=CC=C (C=C3) Cl.Cl

Molecular Formula

C15H14Cl2N2

Molecular Weight

293.2 g/mol

Controlled

Yes

Chemical Information

Chlormidazole hydrochloride

CAS Number	74298-63-8
PubChem CID	11346885
IUPAC Name	1-[(4-chlorophenyl)methyl]-2-methylbenzimidazole;hydrochloride
Molecular Formula	C15H14Cl2N2
Molecular Weight	293.2
Topological Polar Surface Area	17.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	19
Formal Charge	0
Complexity	276

SMILES

CC1=NC2=CC=CC=C2N1CC3=CC=C(C=C3)Cl.Cl

InChI

InChI=1S/C15H13ClN2.ClH/c1-11-17-14-4-2-3-5-15(14)18(11)10-12-6-8-13(16)9-7-12;/h2-9H,10H2,1H3;1H

InChIKey

MHMTXDMLQZHXRZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 74298-63-8

CID: 11346885

Formula: C15H14Cl2N2

MW: 293.2

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	293.2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	292.0534038
Monoisotopic Mass	292.0534038
Topological Polar Surface Area	17.8 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	276
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

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