Cat Number: CIA96702033

Ectoine

CAS Number

96702-03-3

Synonyms

(S)-2-METHYL-1,4,5,6-TETRAHYDROPYRIMIDINE-4-CARBOXYLIC ACID;THP[B];ECTOINE;2-METHYL-1,4,5,6-TETRAHYDROPYRIMIDINE-4-CARBOXYLIC ACID;(S)-1,4,5,6-Tetrahydro-2-methyl-4-pyrimidincarbonsure;Ectoine sodium salt monohydrate

INCI Name

Ectoine

Description

Ectoine is a carboxamidine heterocycle obtained by formal condensation of (2S)-2,4-diaminobutanoic acid with acetic acid. It has a role as an osmolyte. It is a carboxamidine, a member of 1,4,5,6-tetrahydropyrimidines and a monocarboxylic acid. It is a conjugate acid of an ectoinate. It is a tautomer of an ectoine zwitterion.

Molecular Weight

142.16

Molecular Formula

C6H10N2O2

EINECS

431-910-1

InChI

InChI=1S/C6H10N2O2/c1-4-7-3-2-5(8-4)6(9)10/h5H,2-3H2,1H3,(H,7,8)(H,9,10)/t5-/m0/s1

InChIKey

WQXNXVUDBPYKBA-YFKPBYRVSA-N

SMILES

C1(C)=NCC[C@@H](C(O)=O)N1

Appearance

Solid

Color

White to Off-White

Storage

2-8℃

pKa

3.14±0.20(Predicted)

Boiling Point

381.5±35.0 ℃(Predicted)

Density, g/cm3

1.37

Melting Point

~280°

HOURS

Daily: 9.30 AM–6.00 PM
Sunday : 9.30 AM–1.00 PM
Holidays: Closed

INFORMATION

Tel:
E-mail:
Address:
WhatsAPP

Member of