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130198-05-9 | Cyclohexanol, 1-[2-amino-1-(4-methoxyphenyl)ethyl]-, hydrochloride (1:1)
CAS No: 130198-05-9 Catalog No: AG000U4L MDL No:MFCD06658143
Product Description
Catalog Number:
AG000U4L
Chemical Name:
Cyclohexanol, 1-[2-amino-1-(4-methoxyphenyl)ethyl]-, hydrochloride (1:1)
CAS Number:
130198-05-9
Molecular Formula:
C15H24ClNO2
Molecular Weight:
285.8096
MDL Number:
MFCD06658143
IUPAC Name:
1-[2-amino-1-(4-methoxyphenyl)ethyl]cyclohexan-1-ol;hydrochloride
InChI:
InChI=1S/C15H23NO2.ClH/c1-18-13-7-5-12(6-8-13)14(11-16)15(17)9-3-2-4-10-15;/h5-8,14,17H,2-4,9-11,16H2,1H3;1H
InChI Key:
NTKXIDDUCSFBBF-UHFFFAOYSA-N
SMILES:
NCC(C1(O)CCCCC1)c1ccc(cc1)OC.Cl
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.15g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
285.812g/mol
Monoisotopic Mass:
285.15g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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