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Home Other Building Blocks (5-Nitro-1H-1,3-benzodiazol-2-yl)methanol

(5-Nitro-1H-1,3-benzodiazol-2-yl)methanol

CAS No.:
20034-00-8
Catalog Number:
AG002CPN
Molecular Formula:
C8H7N3O3
Molecular Weight:
193.1595
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$63
- +
5g
98%
In Stock USA
United States
$188
- +
10g
98%
In Stock USA
United States
$313
- +
Product Description
Catalog Number:
AG002CPN
Chemical Name:
(5-Nitro-1H-1,3-benzodiazol-2-yl)methanol
CAS Number:
20034-00-8
Molecular Formula:
C8H7N3O3
Molecular Weight:
193.1595
MDL Number:
MFCD00462582
IUPAC Name:
(6-nitro-1H-benzimidazol-2-yl)methanol
InChI:
InChI=1S/C8H7N3O3/c12-4-8-9-6-2-1-5(11(13)14)3-7(6)10-8/h1-3,12H,4H2,(H,9,10)
InChI Key:
ZJLPIDVKNQXTKN-UHFFFAOYSA-N
SMILES:
OCc1nc2c([nH]1)cc(cc2)[N+](=O)[O-]
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:
2  
Isotope Atom Count:
0
Molecular Weight:
193.162g/mol
Monoisotopic Mass:
193.049g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
94.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties