4-bromo-3-chlorobenzene-1,2-diamine


Chemical Name: 4-bromo-3-chlorobenzene-1,2-diamine
CAS Number: 1008361-80-5
Product Number: AG0002ZM(AGN-PC-0BWMT0)
Synonyms:
MDL No:
Molecular Formula: C6H6BrClN2
Molecular Weight: 221.4822

Identification/Properties


Computed Properties
Molecular Weight:
221.482g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
219.94g/mol
Monoisotopic Mass:
219.94g/mol
Topological Polar Surface Area:
52A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
122
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


PNMR/4-BROMO-3-CHLORO-1-2-BENZENEDIAMINE_1008361-80-5_hnmr.pdf

Other Analytical Data


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