N-Allyl-1-phenylcyclohexanamine hydrochloride

CAT: 0926-FA133606-01Size: 500 mgDry Ice: NoHazardous: No

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CAT#:0926-FA133606-01Size:500 mg

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CAS Number

2201-49-2

Synonyms

Allyl (1-phenylcyclohexyl) amine hydrochloride; cyclohexanamine, 1-phenyl-N-2-propenyl-, hydrochloride

MDL Number

MFCD01735229

Smiles

C=CCNC1 (CCCCC1) C2=CC=CC=C2.Cl

Molecular Formula

C15H21N

Molecular Weight

215.33 g/mol

Controlled

Yes

Chemical Information

1-phenyl-N-prop-2-enylcyclohexan-1-amine

CAS Number	2201-49-2
PubChem CID	200514
IUPAC Name	1-phenyl-N-prop-2-enylcyclohexan-1-amine
Molecular Formula	C15H21N
Molecular Weight	215.33
XLogP	3.5
Topological Polar Surface Area	12
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Heavy Atom Count	16
Formal Charge	0
Complexity	209

SMILES

C=CCNC1(CCCCC1)C2=CC=CC=C2

InChI

InChI=1S/C15H21N/c1-2-13-16-15(11-7-4-8-12-15)14-9-5-3-6-10-14/h2-3,5-6,9-10,16H,1,4,7-8,11-13H2

InChIKey

BLMUJVQXHXLMDT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2201-49-2

CID: 200514

Formula: C15H21N

MW: 215.33

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	215.33
XLogP3	3.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Exact Mass	215.167399674
Monoisotopic Mass	215.167399674
Topological Polar Surface Area	12 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	209
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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N-Allyl-1-phenylcyclohexanamine hydrochloride

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