中文版English

CAS Number: 16034-49-4
2-(3,5-dimethyl-1H-pyrazol-1-yl)acetic acid

Structure

2-(3,5-dimethyl-1H-pyrazol-1-yl)acetic acid
Name: 2-(3,5-dimethyl-1H-pyrazol-1-yl)acetic acid
Synonyms:
General Information
Product Number: 16034494
CAS Registry Number: 16034-49-4
Name:
1H-​Pyrazole-​1-​acetic acid, 3,​5-​dimethyl-
Pyrazole-​1-​acetic acid, 3,​5-​dimethyl- (8CI); (3,​5-​Dimethyl-​1H-​pyrazol-​1-​yl)​acetic acid; 2-​(3,​5-​Dimethylpyrazol-​1-​yl)​acetic acid; 3,​5-​Dimethyl-​1-​pyrazolylacetic acid 
 
Chemical Formula: C7H10N2O2
Exact Mass: 154.07
Molecular Weight: 154.17
m/z: 154.07 (100.0%), 155.08 (7.8%)
Elemental Analysis: C, 54.54; H, 6.54; N, 18.17; O, 20.76
 
InChI: InChI=1S/C7H10N2O2/c1-5-3-6(2)9(8-5)4-7(10)11/h3H,4H2,1-2H3,(H,10,11)
InChIKey: JYSWEDYPQJOEPO-UHFFFAOYSA-N
Canonical SMILES : CC1=CC(=NN1CC(=O)O)C
 
Thermal Properties Value Condition Note
Boiling Point 120-127 °C Press: 14 Torr (1)CAS
Melting Point 182 °C Solv: ethanol (64-17-5) (1)CAS
Melting Point 178-180 °C Solv: ethanol (64-17-5) (3)IC
Melting Point 30-30.5 °C   (1)CAS

Specification

98%

References
  1. (1) Habraken, Clarisse L.; Recueil des Travaux Chimiques des Pays-Bas 1966, V85(11), P1194-6 CAPLUS
  2. (2) Boa, Andrew N.; Acta Crystallographica, Section E: Structure Reports Online 2004, V60(6), Po966-o967 CAPLUS
  3. (3) Ochi, Hisao; Yakugaku Zasshi 1978, V98(2), P165-71 CAPLUS
Contact Us
TEL:  86-17758012822
FAX:  86-571-87759731
E-mail:sales@hzchempro.com
[ CLOSE ]