Home Halogens 5-chlorobenzene-1,2,3-triamine

5-chlorobenzene-1,2,3-triamine

CAS No.:
100114-53-2
Catalog Number:
AG01DUVX
Molecular Formula:
C6H8ClN3
Molecular Weight:
157.6008
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Product Description
Catalog Number:
AG01DUVX
Chemical Name:
5-chlorobenzene-1,2,3-triamine
CAS Number:
100114-53-2
Molecular Formula:
C6H8ClN3
Molecular Weight:
157.6008
MDL Number:
MFCD20696077
IUPAC Name:
5-chlorobenzene-1,2,3-triamine
InChI:
InChI=1S/C6H8ClN3/c7-3-1-4(8)6(10)5(9)2-3/h1-2H,8-10H2
InChI Key:
JIGLHKJLEWNHSS-UHFFFAOYSA-N
SMILES:
Clc1cc(N)c(c(c1)N)N
NSC Number:
364048
Properties
Complexity:
108  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
157.041g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
157.601g/mol
Monoisotopic Mass:
157.041g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
78.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties