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(S) -3-Aminohexan-1-ol hydrochloride

CAT: 0127-OR1039910-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0127-OR1039910-01Size:1 g
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CAS Number
68889-62-3
MDL Number
MFCD23701471
Purity
98%
Smiles
CCC[C@@H](CCO)N.Cl

Chemical Information

(3S)-3-aminohexan-1-ol hydrochloride
CAS Number68889-62-3
PubChem CID71463751
IUPAC Name(3S)-3-aminohexan-1-ol;hydrochloride
Molecular FormulaC6H16ClNO
Molecular Weight153.65
Topological Polar Surface Area46.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count9
Formal Charge0
Complexity47
SMILES
CCC[C@@H](CCO)N.Cl
InChI
InChI=1S/C6H15NO.ClH/c1-2-3-6(7)4-5-8;/h6,8H,2-5,7H2,1H3;1H/t6-;/m0./s1
InChIKey
LWUKXXYWSXUWIF-RGMNGODLSA-N
Chemical Structure
2D Structure
2D structure of (3S)-3-aminohexan-1-ol hydrochloride
CAS: 68889-62-3
CID: 71463751
Formula: C6H16ClNO
MW: 153.65
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight153.65
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass153.0920418
Monoisotopic Mass153.0920418
Topological Polar Surface Area46.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity47.8
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes