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838847-23-7 | 3-PIPERIDINOL, 4-(AMINOMETHYL)-1-(3-METHOXYPROPYL)-, (3S,4S)-
CAS No: 838847-23-7 Catalog No: AG004VEP MDL No:
Product Description
Catalog Number:
AG004VEP
Chemical Name:
3-PIPERIDINOL, 4-(AMINOMETHYL)-1-(3-METHOXYPROPYL)-, (3S,4S)-
CAS Number:
838847-23-7
Molecular Formula:
C10H22N2O2
Molecular Weight:
202.2939
IUPAC Name:
(3S,4S)-4-(aminomethyl)-1-(3-methoxypropyl)piperidin-3-ol
InChI:
InChI=1S/C10H22N2O2/c1-14-6-2-4-12-5-3-9(7-11)10(13)8-12/h9-10,13H,2-8,11H2,1H3/t9-,10+/m0/s1
InChI Key:
QOQDPKUFRNVBOG-VHSXEESVSA-N
SMILES:
COCCCN1CC[C@H]([C@@H](C1)O)CN
Properties
Complexity:
155
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
202.168g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
202.298g/mol
Monoisotopic Mass:
202.168g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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