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130818-96-1 | Ethanol, 2-[[1-(phenylmethyl)-4-piperidinyl]amino]-
CAS No: 130818-96-1 Catalog No: AG000UZN MDL No:MFCD11152535
Product Description
Catalog Number:
AG000UZN
Chemical Name:
Ethanol, 2-[[1-(phenylmethyl)-4-piperidinyl]amino]-
CAS Number:
130818-96-1
Molecular Formula:
C14H22N2O
Molecular Weight:
234.3373
MDL Number:
MFCD11152535
IUPAC Name:
2-[(1-benzylpiperidin-4-yl)amino]ethanol
InChI:
InChI=1S/C14H22N2O/c17-11-8-15-14-6-9-16(10-7-14)12-13-4-2-1-3-5-13/h1-5,14-15,17H,6-12H2
InChI Key:
KXSSEEPLNUNWMD-UHFFFAOYSA-N
SMILES:
OCCNC1CCN(CC1)Cc1ccccc1
Properties
Complexity:
196
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:
2
Isotope Atom Count:
0
Molecular Weight:
234.343g/mol
Monoisotopic Mass:
234.173g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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