Home Other Building Blocks [4-(2-methoxy-5-methylphenyl)oxan-4-yl]methanamine

[4-(2-methoxy-5-methylphenyl)oxan-4-yl]methanamine

CAS No.:
1152568-32-5
Catalog Number:
AG019X7V
Molecular Formula:
C14H21NO2
Molecular Weight:
235.3220
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Product Description
Catalog Number:
AG019X7V
Chemical Name:
[4-(2-methoxy-5-methylphenyl)oxan-4-yl]methanamine
CAS Number:
1152568-32-5
Molecular Formula:
C14H21NO2
Molecular Weight:
235.3220
MDL Number:
MFCD10692698
IUPAC Name:
[4-(2-methoxy-5-methylphenyl)oxan-4-yl]methanamine
InChI:
InChI=1S/C14H21NO2/c1-11-3-4-13(16-2)12(9-11)14(10-15)5-7-17-8-6-14/h3-4,9H,5-8,10,15H2,1-2H3
InChI Key:
IGCCIDMLRGNVFE-UHFFFAOYSA-N
SMILES:
NCC1(CCOCC1)c1cc(C)ccc1OC
Properties
Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.157g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
235.327g/mol
Monoisotopic Mass:
235.157g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties