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Ropivacaine Impurity 38

CAT: 1299-RM-R162238-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-R162238-01Size:10 mg
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CAS Number
99552-32-6
Synonyms
N- (2,4-dimethylphenyl) piperidine-2-carboxamide
Molecular Formula
C14H20N2O
Molecular Weight
232.32
Target Alternative Name
Ropivacaine
Product Name Synonym
N- (2,4-dimethylphenyl) piperidine-2-carboxamide

Chemical Information

N-(2,4-dimethylphenyl)piperidine-2-carboxamide
CAS Number99552-32-6
PubChem CID10728300
IUPAC NameN-(2,4-dimethylphenyl)piperidine-2-carboxamide
Molecular FormulaC14H20N2O
Molecular Weight232.32
XLogP2.3
Topological Polar Surface Area41.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count17
Formal Charge0
Complexity267
SMILES
CC1=CC(=C(C=C1)NC(=O)C2CCCCN2)C
InChI
InChI=1S/C14H20N2O/c1-10-6-7-12(11(2)9-10)16-14(17)13-5-3-4-8-15-13/h6-7,9,13,15H,3-5,8H2,1-2H3,(H,16,17)
InChIKey
MMGNWABXVJFAIQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(2,4-dimethylphenyl)piperidine-2-carboxamide
CAS: 99552-32-6
CID: 10728300
Formula: C14H20N2O
MW: 232.32
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight232.32
XLogP32.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass232.157563266
Monoisotopic Mass232.157563266
Topological Polar Surface Area41.1 Ų
Heavy Atom Count17
Formal Charge0
Complexity267
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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