Products for Research Use Only

Lachesine hydrochloride

CAT: 0926-FL67324-01Size: 5 gDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0926-FL67324-01Size:5 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1164-38-1
Synonyms
Lachesine chloride
MDL Number
MFCD00867671
Smiles
CC[N+] (C) (C) CCOC (=O) C (C1=CC=CC=C1) (C2=CC=CC=C2) O.[Cl-]
Molecular Formula
C20H26ClNO3
Molecular Weight
363.88 g/mol
Controlled
No

Chemical Information

Lachesine Chloride
CAS Number1164-38-1
PubChem CID14415
IUPAC Nameethyl-[2-(2-hydroxy-2,2-diphenylacetyl)oxyethyl]-dimethylazanium chloride
Molecular FormulaC20H26ClNO3
Molecular Weight363.9
Topological Polar Surface Area46.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Heavy Atom Count25
Formal Charge0
Complexity378
SMILES
CC[N+](C)(C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.[Cl-]
InChI
InChI=1S/C20H26NO3.ClH/c1-4-21(2,3)15-16-24-19(22)20(23,17-11-7-5-8-12-17)18-13-9-6-10-14-18;/h5-14,23H,4,15-16H2,1-3H3;1H/q+1;/p-1
InChIKey
TVCAZGSWNBZVJN-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Lachesine Chloride
CAS: 1164-38-1
CID: 14415
Formula: C20H26ClNO3
MW: 363.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight363.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count8
Exact Mass363.1601214
Monoisotopic Mass363.1601214
Topological Polar Surface Area46.5 Ų
Heavy Atom Count25
Formal Charge0
Complexity378
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