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33786-89-9 | 5-Chlorobenzene-1,3-diamine
CAS No: 33786-89-9 Catalog No: AG003MON MDL No:MFCD00014775
Product Description
Catalog Number:
AG003MON
Chemical Name:
5-Chlorobenzene-1,3-diamine
CAS Number:
33786-89-9
Molecular Formula:
C6H7ClN2
Molecular Weight:
142.5862
MDL Number:
MFCD00014775
IUPAC Name:
5-chlorobenzene-1,3-diamine
InChI:
InChI=1S/C6H7ClN2/c7-4-1-5(8)3-6(9)2-4/h1-3H,8-9H2
InChI Key:
VZNUCJOYPXKLTA-UHFFFAOYSA-N
SMILES:
Nc1cc(N)cc(c1)Cl
Properties
Complexity:
87.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.03g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
142.586g/mol
Monoisotopic Mass:
142.03g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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