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89123-01-3 | 3-bromo-1-propanesulfonyl chloride
CAS No: 89123-01-3 Catalog No: AG003Z5A MDL No:MFCD19200078
Product Description
Catalog Number:
AG003Z5A
Chemical Name:
3-bromo-1-propanesulfonyl chloride
CAS Number:
89123-01-3
Molecular Formula:
C3H6BrClO2S
Molecular Weight:
221.5005
MDL Number:
MFCD19200078
IUPAC Name:
3-bromopropane-1-sulfonyl chloride
InChI:
InChI=1S/C3H6BrClO2S/c4-2-1-3-8(5,6)7/h1-3H2
InChI Key:
VZHZFZVIDRJWSK-UHFFFAOYSA-N
SMILES:
BrCCCS(=O)(=O)Cl
NSC Number:
151044
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.896g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.493g/mol
Monoisotopic Mass:
219.896g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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