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131288-67-0 | Cyclohexanepropanol, β-amino-, (βS)-
CAS No: 131288-67-0 Catalog No: AG000VUU MDL No:MFCD00191731
Product Description
Catalog Number:
AG000VUU
Chemical Name:
Cyclohexanepropanol, β-amino-, (βS)-
CAS Number:
131288-67-0
Molecular Formula:
C9H19NO
Molecular Weight:
157.2533
MDL Number:
MFCD00191731
IUPAC Name:
(2S)-2-amino-3-cyclohexylpropan-1-ol
InChI:
InChI=1S/C9H19NO/c10-9(7-11)6-8-4-2-1-3-5-8/h8-9,11H,1-7,10H2/t9-/m0/s1
InChI Key:
QWDRYURVUDZKSG-VIFPVBQESA-N
SMILES:
OC[C@H](CC1CCCCC1)N
Properties
Complexity:
99.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
157.147g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
157.257g/mol
Monoisotopic Mass:
157.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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