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Octacaine hydrochloride

CAT: 0931-T33777L-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T33777L-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
93940-32-0
Target
Others
Related Pathways
Others
Bioactivity
Octacaine hydrochloride is a biochemical.
Smiles
Cl.O=C(NC=1C=CC=CC1)CC(N(CC)CC)C
Molecular Formula
C14H23ClN2O
Molecular Weight
270.8
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Octacaine hydrochloride
CAS Number93940-32-0
PubChem CID3022973
IUPAC Name3-(diethylamino)-N-phenylbutanamide;hydrochloride
Molecular FormulaC14H23ClN2O
Molecular Weight270.80
Topological Polar Surface Area32.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Heavy Atom Count18
Formal Charge0
Complexity220
SMILES
CCN(CC)C(C)CC(=O)NC1=CC=CC=C1.Cl
InChI
InChI=1S/C14H22N2O.ClH/c1-4-16(5-2)12(3)11-14(17)15-13-9-7-6-8-10-13;/h6-10,12H,4-5,11H2,1-3H3,(H,15,17);1H
InChIKey
AFAGKKJVZIQRMO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Octacaine hydrochloride
CAS: 93940-32-0
CID: 3022973
Formula: C14H23ClN2O
MW: 270.80
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight270.80
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count6
Exact Mass270.1498911
Monoisotopic Mass270.1498911
Topological Polar Surface Area32.3 Ų
Heavy Atom Count18
Formal Charge0
Complexity220
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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