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1126084-45-4 | 1-(piperidin-4-yl)propan-2-ol hydrochloride
CAS No: 1126084-45-4 Catalog No: AG01EMEA MDL No:
Product Description
Catalog Number:
AG01EMEA
Chemical Name:
1-(piperidin-4-yl)propan-2-ol hydrochloride
CAS Number:
1126084-45-4
Molecular Formula:
C8H18ClNO
Molecular Weight:
179.6876
IUPAC Name:
1-piperidin-4-ylpropan-2-ol;hydrochloride
InChI:
InChI=1S/C8H17NO.ClH/c1-7(10)6-8-2-4-9-5-3-8;/h7-10H,2-6H2,1H3;1H
InChI Key:
TYTJKSCTAYUACP-UHFFFAOYSA-N
SMILES:
CC(CC1CCNCC1)O.Cl
Properties
Complexity:
89.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.108g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
179.688g/mol
Monoisotopic Mass:
179.108g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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