Structure

2,3,5,6-Tetrachloroaniline

CAS
3481-20-7
Catalog Number
ACM3481207
Category
Other Products
Molecular Weight
230.9
Molecular Formula
C6H3Cl4N

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Specification

Synonyms
Benzenamine, 2,3,5,6-tetrachloro-
IUPAC Name
2,3,5,6-tetrachloroaniline
SMILES
C1=C(C(=C(C(=C1Cl)Cl)N)Cl)Cl
InChI Key
YTDHEFNWWHSXSU-UHFFFAOYSA-N
Boiling Point
299.1ºC at 760mmHg
Melting Point
106ºC
Flash Point
134.7ºC
Density
1.655g/cm³
Complexity
129
Defined Atom Stereocenter Count
0
EC Number
222-461-9
Exact Mass
230.8990
Formal Charge
0
Hazard Statements
T: Toxic;
H-Bond Acceptor
1
H-Bond Donor
1
Heavy Atom Count
11
Hydrogen Bond Acceptor Count
1
Hydrogen Bond Donor Count
1
Isotope Atom Count
0
Monoisotopic Mass
230.8990
Rotatable Bond Count
0
Safety Description
36/37-45
Topological Polar Surface Area
26 Ų
XLogP3-AA
4.5

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