Home Halogens 2-(4-chloro-3-methoxyphenyl)ethan-1-amine

2-(4-chloro-3-methoxyphenyl)ethan-1-amine

CAS No.:
96495-22-6
Catalog Number:
AG01AMT8
Molecular Formula:
C9H12ClNO
Molecular Weight:
185.6507
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Product Description
Catalog Number:
AG01AMT8
Chemical Name:
2-(4-chloro-3-methoxyphenyl)ethan-1-amine
CAS Number:
96495-22-6
Molecular Formula:
C9H12ClNO
Molecular Weight:
185.6507
MDL Number:
MFCD20693578
IUPAC Name:
2-(4-chloro-3-methoxyphenyl)ethanamine
InChI:
InChI=1S/C9H12ClNO/c1-12-9-6-7(4-5-11)2-3-8(9)10/h2-3,6H,4-5,11H2,1H3
InChI Key:
WXOYNGLGBUBNFN-UHFFFAOYSA-N
SMILES:
NCCc1ccc(c(c1)OC)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:
185.061g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
185.651g/mol
Monoisotopic Mass:
185.061g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties