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85822-16-8 | 4-Formylbenzene-1-sulfonyl chloride
CAS No: 85822-16-8 Catalog No: AG008GFR MDL No:MFCD01861215
Product Description
Catalog Number:
AG008GFR
Chemical Name:
4-Formylbenzene-1-sulfonyl chloride
CAS Number:
85822-16-8
Molecular Formula:
C7H5ClO3S
Molecular Weight:
204.6308
MDL Number:
MFCD01861215
IUPAC Name:
4-formylbenzenesulfonyl chloride
InChI:
InChI=1S/C7H5ClO3S/c8-12(10,11)7-3-1-6(5-9)2-4-7/h1-5H
InChI Key:
MSWSPWGBDIQKKR-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)S(=O)(=O)Cl
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.965g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.624g/mol
Monoisotopic Mass:
203.965g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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