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90110-72-8

90110-72-8 | Benzimidazole, 4-methoxy-5-nitro- (7CI)

CAS No: 90110-72-8 Catalog No: AG00H0Q7 MDL No:

Product Description

Catalog Number:
AG00H0Q7
Chemical Name:
Benzimidazole, 4-methoxy-5-nitro- (7CI)
CAS Number:
90110-72-8
IUPAC Name:
4-methoxy-5-nitro-1H-benzimidazole
InChI:
InChI=1S/C8H7N3O3/c1-14-8-6(11(12)13)3-2-5-7(8)10-4-9-5/h2-4H,1H3,(H,9,10)
InChI Key:
DVJZRZPQFCUEGO-UHFFFAOYSA-N

Properties

Complexity:
230  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.049g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
193.162g/mol
Monoisotopic Mass:
193.049g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
83.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

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