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17345-74-3 | 1,2,3-Benzenetriol, 4,5,6-tribromo-
CAS No: 17345-74-3 Catalog No: AG001YXP MDL No:
Product Description
Catalog Number:
AG001YXP
Chemical Name:
1,2,3-Benzenetriol, 4,5,6-tribromo-
CAS Number:
17345-74-3
Molecular Formula:
C6H3Br3O3
Molecular Weight:
362.7982
IUPAC Name:
4,5,6-tribromobenzene-1,2,3-triol
InChI:
InChI=1S/C6H3Br3O3/c7-1-2(8)4(10)6(12)5(11)3(1)9/h10-12H
InChI Key:
ARJKUIKBPQATMT-UHFFFAOYSA-N
SMILES:
Oc1c(O)c(Br)c(c(c1O)Br)Br
NSC Number:
16931
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.761g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
362.799g/mol
Monoisotopic Mass:
359.763g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
60.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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