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Details

Stereochemistry MIXED
Molecular Formula C9H21NO3.C5H10O4
Molecular Weight 325.3984
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRIISOPROPANOLAMINE DIMETHYLOLPROPIONATE

SMILES

CC(CO)(CO)C(O)=O.CC(O)CN(CC(C)O)CC(C)O

InChI

InChIKey=BFBKTYXQTMKYOQ-UHFFFAOYSA-N
InChI=1S/C9H21NO3.C5H10O4/c1-7(11)4-10(5-8(2)12)6-9(3)13;1-5(2-6,3-7)4(8)9/h7-9,11-13H,4-6H2,1-3H3;6-7H,2-3H2,1H3,(H,8,9)

HIDE SMILES / InChI

Molecular Formula C9H21NO3
Molecular Weight 191.2679
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula C5H10O4
Molecular Weight 134.1305
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:17:56 GMT 2023
Edited
by admin
on Sat Dec 16 08:17:56 GMT 2023
Record UNII
T15A7711XM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRIISOPROPANOLAMINE DIMETHYLOLPROPIONATE
Common Name English
PROPANOIC ACID, 3-HYDROXY-2-(HYDROXYMETHYL)-2-METHYL-, COMPD. WITH 1,1',1''-NITRILOTRIS(2-PROPANOL)(1:1)
Common Name English
PROPANOIC ACID, 3-HYDROXY-2-(HYDROXYMETHYL)-2-METHYL-, COMPD. WITH 1,1',1''-NITRILOTRIS(2-PROPANOL) (1:1)
Systematic Name English
2-PROPANOL, 1,1',1''-NITRILOTRIS-, 3-HYDROXY-2-(HYDROXYMETHYL)-2-METHYLPROPANOATE (SALT)
Systematic Name English
Code System Code Type Description
FDA UNII
T15A7711XM
Created by admin on Sat Dec 16 08:17:57 GMT 2023 , Edited by admin on Sat Dec 16 08:17:57 GMT 2023
PRIMARY
CAS
221281-21-6
Created by admin on Sat Dec 16 08:17:57 GMT 2023 , Edited by admin on Sat Dec 16 08:17:57 GMT 2023
PRIMARY
PUBCHEM
119058021
Created by admin on Sat Dec 16 08:17:57 GMT 2023 , Edited by admin on Sat Dec 16 08:17:57 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
PARENT -> SALT/SOLVATE