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951883-98-0 | 1-((2-Bromophenyl);sulfonyl);piperidine
CAS No: 951883-98-0 Catalog No: AG003CRV MDL No:MFCD09800969
Product Description
Catalog Number:
AG003CRV
Chemical Name:
1-((2-Bromophenyl);sulfonyl);piperidine
CAS Number:
951883-98-0
Molecular Formula:
C11H14BrNO2S
Molecular Weight:
304.2034
MDL Number:
MFCD09800969
IUPAC Name:
1-(2-bromophenyl)sulfonylpiperidine
InChI:
InChI=1S/C11H14BrNO2S/c12-10-6-2-3-7-11(10)16(14,15)13-8-4-1-5-9-13/h2-3,6-7H,1,4-5,8-9H2
InChI Key:
QVJWVAUVIDEPPD-UHFFFAOYSA-N
SMILES:
Brc1ccccc1S(=O)(=O)N1CCCCC1
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.993g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
304.202g/mol
Monoisotopic Mass:
302.993g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
45.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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