Home Halogens 4-chloro-3-[(dimethylamino)methyl]aniline

4-chloro-3-[(dimethylamino)methyl]aniline

CAS No.:
697305-72-9
Catalog Number:
AG01B7I5
Molecular Formula:
C9H13ClN2
Molecular Weight:
184.6659
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Product Description
Catalog Number:
AG01B7I5
Chemical Name:
4-chloro-3-[(dimethylamino)methyl]aniline
CAS Number:
697305-72-9
Molecular Formula:
C9H13ClN2
Molecular Weight:
184.6659
MDL Number:
MFCD10021399
IUPAC Name:
4-chloro-3-[(dimethylamino)methyl]aniline
InChI:
InChI=1S/C9H13ClN2/c1-12(2)6-7-5-8(11)3-4-9(7)10/h3-5H,6,11H2,1-2H3
InChI Key:
CMEATEQCIZPULA-UHFFFAOYSA-N
SMILES:
CN(Cc1cc(N)ccc1Cl)C
Properties
Complexity:
139  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.077g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.667g/mol
Monoisotopic Mass:
184.077g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties