Home Nitros Benzofuran, 2-methyl-5-nitro-

Benzofuran, 2-methyl-5-nitro-

CAS No.:
14146-09-9
Catalog Number:
AG006XMX
Molecular Formula:
C9H7NO3
Molecular Weight:
177.1568
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Product Description
Catalog Number:
AG006XMX
Chemical Name:
Benzofuran, 2-methyl-5-nitro-
CAS Number:
14146-09-9
Molecular Formula:
C9H7NO3
Molecular Weight:
177.1568
MDL Number:
MFCD00460709
IUPAC Name:
2-methyl-5-nitro-1-benzofuran
InChI:
InChI=1S/C9H7NO3/c1-6-4-7-5-8(10(11)12)2-3-9(7)13-6/h2-5H,1H3
InChI Key:
GDQWGORSGRIJCV-UHFFFAOYSA-N
SMILES:
Cc1oc2c(c1)cc(cc2)[N+](=O)[O-]
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.043g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.159g/mol
Monoisotopic Mass:
177.043g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties