Home Halogens (3-chloro-4-ethoxy-5-methoxyphenyl)methanamine

(3-chloro-4-ethoxy-5-methoxyphenyl)methanamine

CAS No.:
938004-61-6
Catalog Number:
AG019VSX
Molecular Formula:
C10H14ClNO2
Molecular Weight:
215.6767
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Product Description
Catalog Number:
AG019VSX
Chemical Name:
(3-chloro-4-ethoxy-5-methoxyphenyl)methanamine
CAS Number:
938004-61-6
Molecular Formula:
C10H14ClNO2
Molecular Weight:
215.6767
MDL Number:
MFCD08554578
IUPAC Name:
(3-chloro-4-ethoxy-5-methoxyphenyl)methanamine
InChI:
InChI=1S/C10H14ClNO2/c1-3-14-10-8(11)4-7(6-12)5-9(10)13-2/h4-5H,3,6,12H2,1-2H3
InChI Key:
HVUKTAJVZURFDP-UHFFFAOYSA-N
SMILES:
CCOc1c(Cl)cc(cc1OC)CN
Properties
Complexity:
168  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.071g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
215.677g/mol
Monoisotopic Mass:
215.071g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties