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Levobupivacaine HCl

CAT: 0607-B1784-50Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0607-B1784-50Size:50 mg
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Description
Sodium channel inhibitor
CAS Number
27262-48-2
Product Name Alternative
(2S)-1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide;hydrochloride
Purity
0.9814
Form
A solid
Solubility
≥15.95 mg/mL in DMSO; ≥28.5 mg/mL in EtOH; ≥48.7 mg/mL in H2O
Smiles
CCCCN1CCCCC1C(=O)NC2=C(C=CC=C2C)C.Cl
Molecular Formula
C18H28N2O·HCl
Molecular Weight
324.89
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

2-Piperidinecarboxamide, 1-butyl-N-(2,6-dimethylphenyl)-, hydrochloride (1:1), (2S)-

Levobupivacaine hydrochloride (anhydrous) is the monohydrochloride salt of levobupivacaine. It has a role as a local anaesthetic, an EC 3.1.1.8 (cholinesterase) inhibitor, an adrenergic antagonist, an amphiphile and an EC 3.6.3.8 (Ca(2+)-transporting ATPase) inhibitor. It contains a levobupivacaine(1+). It is an enantiomer of a dextrobupivacaine hydrochloride (anhydrous).

CAS Number27262-48-2
PubChem CID117965
IUPAC Name(2S)-1-butyl-N-(2,6-dimethylphenyl)piperidine-2-carboxamide;hydrochloride
Molecular FormulaC18H29ClN2O
Molecular Weight324.9
Topological Polar Surface Area32.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Heavy Atom Count22
Formal Charge0
Complexity321
SMILES
CCCCN1CCCC[C@H]1C(=O)NC2=C(C=CC=C2C)C.Cl
InChI
InChI=1S/C18H28N2O.ClH/c1-4-5-12-20-13-7-6-11-16(20)18(21)19-17-14(2)9-8-10-15(17)3;/h8-10,16H,4-7,11-13H2,1-3H3,(H,19,21);1H/t16-;/m0./s1
InChIKey
SIEYLFHKZGLBNX-NTISSMGPSA-N
Chemical Structure
2D Structure
2D structure of 2-Piperidinecarboxamide, 1-butyl-N-(2,6-dimethylphenyl)-, hydrochloride (1:1), (2S)-
CAS: 27262-48-2
CID: 117965
Formula: C18H29ClN2O
MW: 324.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight324.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass324.1968412
Monoisotopic Mass324.1968412
Topological Polar Surface Area32.3 Ų
Heavy Atom Count22
Formal Charge0
Complexity321
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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