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1208078-13-0 | 3-Amino-2,6-dibromo-4-chlorobenzoic acid
CAS No: 1208078-13-0 Catalog No: AG01FBX3 MDL No:MFCD12547838
Product Description
Catalog Number:
AG01FBX3
Chemical Name:
3-Amino-2,6-dibromo-4-chlorobenzoic acid
CAS Number:
1208078-13-0
Molecular Formula:
C7H4Br2ClNO2
Molecular Weight:
329.3732
MDL Number:
MFCD12547838
IUPAC Name:
3-amino-2,6-dibromo-4-chlorobenzoic acid
InChI:
InChI=1S/C7H4Br2ClNO2/c8-2-1-3(10)6(11)5(9)4(2)7(12)13/h1H,11H2,(H,12,13)
InChI Key:
BVZRZLWQOGNPCY-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(Br)cc(c(c1Br)N)Cl
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.828g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
329.372g/mol
Monoisotopic Mass:
326.83g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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