SR-31747 free base 5mg

CAT: 0628-A22199-5Size: 5 mgDry Ice: NoHazardous: No

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CAT#:0628-A22199-5Size:5 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

132173-06-9

Chemical Information

SR-31747 free base

CAS Number	132173-06-9
PubChem CID	6913112
IUPAC Name	N-[(Z)-3-(3-chloro-4-cyclohexylphenyl)prop-2-enyl]-N-ethylcyclohexanamine
Molecular Formula	C23H34ClN
Molecular Weight	360.0
XLogP	7.7
Topological Polar Surface Area	3.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	6
Heavy Atom Count	25
Formal Charge	0
Complexity	395

SMILES

CCN(C/C=C\C1=CC(=C(C=C1)C2CCCCC2)Cl)C3CCCCC3

InChI

InChI=1S/C23H34ClN/c1-2-25(21-13-7-4-8-14-21)17-9-10-19-15-16-22(23(24)18-19)20-11-5-3-6-12-20/h9-10,15-16,18,20-21H,2-8,11-14,17H2,1H3/b10-9-

InChIKey

MYKJVLTXPNIGOV-KTKRTIGZSA-N

Chemical Structure

2D Structure

CAS: 132173-06-9

CID: 6913112

Formula: C23H34ClN

MW: 360.0

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	360.0
XLogP3	7.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	6
Exact Mass	359.2379778
Monoisotopic Mass	359.2379778
Topological Polar Surface Area	3.2 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	395
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes