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85098-70-0

85098-70-0 | 1-(4-Methoxyphenethyl)piperidin-4-amine

CAS No: 85098-70-0 Catalog No: AG003D04 MDL No:MFCD01631147

Product Description

Catalog Number:
AG003D04
Chemical Name:
1-(4-Methoxyphenethyl)piperidin-4-amine
CAS Number:
85098-70-0
Molecular Formula:
C14H22N2O
Molecular Weight:
234.3373
MDL Number:
MFCD01631147
IUPAC Name:
1-[2-(4-methoxyphenyl)ethyl]piperidin-4-amine
InChI:
InChI=1S/C14H22N2O/c1-17-14-4-2-12(3-5-14)6-9-16-10-7-13(15)8-11-16/h2-5,13H,6-11,15H2,1H3
InChI Key:
HTGMIBQQTLUEKV-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)CCN1CCC(CC1)N
EC Number:
285-422-5

Properties

Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.173g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
234.343g/mol
Monoisotopic Mass:
234.173g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
38.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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