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1689-02-7 | 1-Pyrrolidinesulfonyl chloride
CAS No: 1689-02-7 Catalog No: AG001YDA MDL No:MFCD07801104
Product Description
Catalog Number:
AG001YDA
Chemical Name:
1-Pyrrolidinesulfonyl chloride
CAS Number:
1689-02-7
Molecular Formula:
C4H8ClNO2S
Molecular Weight:
169.6298
MDL Number:
MFCD07801104
IUPAC Name:
pyrrolidine-1-sulfonyl chloride
InChI:
InChI=1S/C4H8ClNO2S/c5-9(7,8)6-3-1-2-4-6/h1-4H2
InChI Key:
JRIQCVWTPGVBBH-UHFFFAOYSA-N
SMILES:
ClS(=O)(=O)N1CCCC1
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.996g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.623g/mol
Monoisotopic Mass:
168.996g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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