CAS 61789-40-0|CAS 4292-10-8|cocamidopropyl betaine|2-[(3-dodecanamidopropyl)dimethylazaniumyl]acetate|2-[(3-Dodecanamidopropyl)dimethylaminio]acetate|Cocamidopropyl betaine|Amphitol 20AB|Rikabion B...

General Information

Structure

Molecular Formula

C₁₉H₃₈N₂O₃

Molecular Mass

342.51662

Exact Mass

342.28824309

Charge

InChI

InChI=1S/C19H38N2O3/c1-4-5-6-7-8-9-10-11-12-14-18(22)20-15-13-16-21(2,3)17-19(23)24/h4-17H2,1-3H3,(H-,20,22,23,24)

InChIKey

MRUAUOIMASANKQ-UHFFFAOYSA-N

Canonic Smiles

CCCCCCCCCCCC(=O)NCCC[N+](CC(=O)[O-])(C)C

Isomeric Smiles

CCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(=O)[O-]

Calculated Properties

JChem

Acid pKa

2.2541287

H Acceptors

H Donor

LogD (pH = 5.5)

0.05962004

LogD (pH = 7.4)

0.059822336

Log P

-0.7107075

Molar Refractivity

121.1183

Polarizability

38.796066

Polar Surface Area

69.23

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Academic Data

Wikipedia

Cocamidopropyl_betaine

Commercial Catalog

Data Source

Names and Identifiers

IUPAC Traditional name

cocamidopropyl betaine

IUPAC name

2-[(3-dodecanamidopropyl)dimethylazaniumyl]acetate

Synonyms

2-[(3-Dodecanamidopropyl)dimethylaminio]acetateCocamidopropyl betaineAmphitol 20ABRikabion B 300Anpholex LB 2Rewoteric AMB 12(3-Lauramidopropyl)dimethylbetaineN,N-Dimethyl-N-dodecanoylaminopropylbetaineN-(Carboxymethyl)-N,N-dimethyl-3-[(1-oxododecyl)amino]-1-propanaminium Inner SaltAmphoteric LSoftazoline LPB-R(Carboxymethyl)(3-lauramidopropyl)dimethylammonium Hydroxide Inner SaltDehyton L 12Dimethyl(lauramidopropyl)betaineTego-Betain L 90Lauroylamide PropylbetaineN-(Carboxymethyl)-N,N-dimethyl-3-[(1-oxododecyl)amino]-1-propanaminium Hydroxide Inner SaltSoftazoline LPBAmphosol LBObazoline CABObazoline LAB

Names and Identifiers

Registration numbers

Chemspider ID

19106

EC Number

263-058-8

CAS Number

61789-40-04292-10-8

Wikipedia Title

Cocamidopropyl_betaine

PubChem CID

20280