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147249-42-1 | Benzenemethanamine, 6-amino-2,3-dichloro-
CAS No: 147249-42-1 Catalog No: AG001EQU MDL No:MFCD00728622
Product Description
Catalog Number:
AG001EQU
Chemical Name:
Benzenemethanamine, 6-amino-2,3-dichloro-
CAS Number:
147249-42-1
Molecular Formula:
C7H8Cl2N2
Molecular Weight:
191.0578
MDL Number:
MFCD00728622
IUPAC Name:
2-(aminomethyl)-3,4-dichloroaniline
InChI:
InChI=1S/C7H8Cl2N2/c8-5-1-2-6(11)4(3-10)7(5)9/h1-2H,3,10-11H2
InChI Key:
AUPHGODJXYLKQK-UHFFFAOYSA-N
SMILES:
NCc1c(N)ccc(c1Cl)Cl
Properties
Complexity:
132
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.006g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
191.055g/mol
Monoisotopic Mass:
190.006g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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