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Diethanolamine laurylaminopropionate

HCID 162197
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Basic information

CAS
65104-36-1
Standard SMILES
CCCCCCCCCCCCNCCC(=O)O.OCCNCCO
InChIKey
HGFBWHAXMMRQOA-UHFFFAOYSA-N
Molecular formula
C19H42N2O4
Average molar mass
362.5 g/mol
Monoisotopic mass
362.31445782

Overview

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Names & identifiers

Preferred name
Diethanolamine laurylaminopropionate
IUPAC
3-(dodecylamino)propanoic acid;2-(2-hydroxyethylamino)ethanol
English name
N-dodecyl-beta-alanine, compound with 2,2'-iminodiethanol (1:1)
Molecular formula
C19H42N2O4
Molecular weight
362.54778

Names & synonyms

1D28QRO676diethanolamine laurylaminopropionateDTXSID2070213DIETHANOLAMINE (DEA)-LAURAMINOPROPIONATE.BETA.-ALANINE, N-DODECYL-, SALT WITH 2,2'-IMINODIETHANOLRefChem:586946DTXCID1044485BETA-ALANINE, N-DODECYL-, SALT WITH 2,2'-IMINODIETHANOLETHANOL, 2,2'-IMINOBIS-, COMPD. WITH N-DODECYL-BETA-ALANINE (1:1)DEA-Lauraminopropionate65104-36-1UNII-1D28QRO676
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EINECS 265-417-4N-Dodecyl-beta-alanine, diethanolamine saltSCHEMBL27921314NS00088017Q27252255N-Dodecyl-beta-alanine--2,2'-azanediyldi(ethan-1-ol) (1/1)N-Dodecyl-beta-alanine, compound with 2,2'-iminodiethanol (1:1)

Database identifiers

CAS
65104-36-1
PubChem CID
162197
DTXSID
DTXSID2070213
UNII
1D28QRO676
EC Number
265-417-4

Properties

Computed structural propertiesFilling in

Topological polar surface area
102 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
6
Rotatable bonds
18
Heavy atoms
25
Formal charge
0
Complexity
212

Experimental & physicochemical properties

CosmeticsAntistatic; Hair conditioning

Physicochemical properties

Cosmetics Ingredients Functions
ANTISTATICHAIR CONDITIONING
LogP
5.221 · 5.221 (est)
EWG's Food Scores
1 · 1-3
FDA UNII
1 D28QRO676 · 1D28QRO676
EPA Substance Registry System
2 · .beta.-Alanine, N-dodecyl-, compd. with 2,2'-iminobis[ethanol] (1:1) (65104-36-1)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

Household ProductsInformation on 2 consumer products that contain DEA-Lauraminopropionate in the following categories is provided:
Use ClassificationCosmetics -> Antistatic; Hair conditioning
General Manufacturing Information.beta.-Alanine, N-dodecyl-, compd. with 2,2'-iminobis[ethanol] (1:1): INACTIVE

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Compound notes

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