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Home > Nitro Compounds > 86010-32-4
86010-32-4 | 5-NITRO-1-BENZOTHIOPHENE-2-CARBONYL CHLORIDE
CAS No: 86010-32-4 Catalog No: AG004LSB MDL No:MFCD04115400
Product Description
Catalog Number:
AG004LSB
Chemical Name:
5-NITRO-1-BENZOTHIOPHENE-2-CARBONYL CHLORIDE
CAS Number:
86010-32-4
Molecular Formula:
C9H4ClNO3S
Molecular Weight:
241.6510
MDL Number:
MFCD04115400
IUPAC Name:
5-nitro-1-benzothiophene-2-carbonyl chloride
InChI:
InChI=1S/C9H4ClNO3S/c10-9(12)8-4-5-3-6(11(13)14)1-2-7(5)15-8/h1-4H
InChI Key:
KOJDFXDLYGKDEK-UHFFFAOYSA-N
SMILES:
ClC(=O)c1cc2c(s1)ccc(c2)[N+](=O)[O-]
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.96g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.645g/mol
Monoisotopic Mass:
240.96g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
91.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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