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Trans-4-Methoxycyclohexanamine hydrochloride

CAT: 0127-OR1035663-02Size: 5 gDry Ice: NoHazardous: No
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CAT#:0127-OR1035663-02Size:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
61367-41-7
Purity
97%
Smiles
N[C@H]1CC[C@H](OC)CC1.Cl

Chemical Information

(1s,4s)-4-Methoxycyclohexan-1-amine hydrochloride

See also: Cyclohexanamine,4-methoxy-,hydrochloride (annotation moved to).

CAS Number61367-41-7
PubChem CID21305025
IUPAC Name4-methoxycyclohexan-1-amine;hydrochloride
Molecular FormulaC7H16ClNO
Molecular Weight165.66
Topological Polar Surface Area35.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count10
Formal Charge0
Complexity77
SMILES
COC1CCC(CC1)N.Cl
InChI
InChI=1S/C7H15NO.ClH/c1-9-7-4-2-6(8)3-5-7;/h6-7H,2-5,8H2,1H3;1H
InChIKey
DUVKXMNYICFZCS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (1s,4s)-4-Methoxycyclohexan-1-amine hydrochloride
CAS: 61367-41-7
CID: 21305025
Formula: C7H16ClNO
MW: 165.66
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight165.66
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass165.0920418
Monoisotopic Mass165.0920418
Topological Polar Surface Area35.3 Ų
Heavy Atom Count10
Formal Charge0
Complexity77
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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