Products for Research Use Only

Trans-4-Methoxycyclohexan-1-amine

CAT: 0127-OR54676-01Size: 250 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0127-OR54676-01Size:250 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
121588-79-2
MDL Number
MFCD20278175
Purity
98%
Smiles
CO[C@@H]1CC[C@@H](N)CC1

Chemical Information

(trans-4-Methoxycyclohexyl)amine
CAS Number121588-79-2
PubChem CID409910
IUPAC Name4-methoxycyclohexan-1-amine
Molecular FormulaC7H15NO
Molecular Weight129.20
XLogP0.5
Topological Polar Surface Area35.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity77
SMILES
COC1CCC(CC1)N
InChI
InChI=1S/C7H15NO/c1-9-7-4-2-6(8)3-5-7/h6-7H,2-5,8H2,1H3
InChIKey
SDMXLAZIFYYECU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of (trans-4-Methoxycyclohexyl)amine
CAS: 121588-79-2
CID: 409910
Formula: C7H15NO
MW: 129.20
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight129.20
XLogP30.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass129.115364102
Monoisotopic Mass129.115364102
Topological Polar Surface Area35.3 Ų
Heavy Atom Count9
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 Count1
Compound Is CanonicalizedYes