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100191-23-9 | Benzenamine, 2,4,6-tribromo-N-sulfinyl-
CAS No: 100191-23-9 Catalog No: AG00017G MDL No:
Product Description
Catalog Number:
AG00017G
Chemical Name:
Benzenamine, 2,4,6-tribromo-N-sulfinyl-
CAS Number:
100191-23-9
Molecular Formula:
C6H2Br3NOS
Molecular Weight:
375.8632
IUPAC Name:
1,3,5-tribromo-2-(sulfinylamino)benzene
InChI:
InChI=1S/C6H2Br3NOS/c7-3-1-4(8)6(10-12-11)5(9)2-3/h1-2H
InChI Key:
ACJBVGCMPITPIQ-UHFFFAOYSA-N
SMILES:
O=S=Nc1c(Br)cc(cc1Br)Br
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.739g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
375.86g/mol
Monoisotopic Mass:
372.741g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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