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Home Other Building Blocks methyl 2-(1H-1,3-benzodiazol-2-yl)acetate hydrochloride

methyl 2-(1H-1,3-benzodiazol-2-yl)acetate hydrochloride

CAS No.:
1052528-15-0
Catalog Number:
AG019HM7
Molecular Formula:
C10H11ClN2O2
Molecular Weight:
226.6595
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Product Description
Catalog Number:
AG019HM7
Chemical Name:
methyl 2-(1H-1,3-benzodiazol-2-yl)acetate hydrochloride
CAS Number:
1052528-15-0
Molecular Formula:
C10H11ClN2O2
Molecular Weight:
226.6595
MDL Number:
MFCD07279767
IUPAC Name:
methyl 2-(1H-benzimidazol-2-yl)acetate;hydrochloride
InChI:
InChI=1S/C10H10N2O2.ClH/c1-14-10(13)6-9-11-7-4-2-3-5-8(7)12-9;/h2-5H,6H2,1H3,(H,11,12);1H
InChI Key:
WPVAFCYVAVDGAZ-UHFFFAOYSA-N
SMILES:
COC(=O)Cc1nc2c([nH]1)cccc2.Cl
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.051g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
226.66g/mol
Monoisotopic Mass:
226.051g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties