Basic information
- CAS
1179337-78-0- Standard SMILES
CC(C)c1cnc(C(=O)O)s1- InChIKey
CKYOUPLMPVJJBY-UHFFFAOYSA-N- Molecular formula
- C7H9NO2S
- Average molar mass
- 171.22 g/mol
- Monoisotopic mass
- 171.0353997
Names & identifiers
- Preferred name
- 5-Isopropylthiazole-2-carboxylic acid
- IUPAC
- 5-propan-2-yl-1,3-thiazole-2-carboxylic acid
- English name
- 5-iso-Propylthiazole-2-carboxylic acid
- Molecular formula
- C7H9NO2S
- Molecular weight
- 171.22
Names & synonyms
1179337-78-05-Isopropylthiazole-2-carboxylic acid5-propan-2-yl-1,3-thiazole-2-carboxylic acid5-Isopropyl-thiazole-2-carboxylic acid5-(Propan-2-yl)-1,3-thiazole-2-carboxylic acidMFCD131818315-Isopropylthiazole-2-carboxylicacidSCHEMBL2139644DTXSID30602157CKYOUPLMPVJJBY-UHFFFAOYSA-NAKOS016009188SB31030
Show more names
5-iso-Propylthiazole-2-carboxylic acid5-Isopropylthiazole-2-carboxylic acid?New5-(1-methylethyl)-2-Thiazolecarboxylic acid5-propan-2-yl-1,3-thiazole-2-carboxylicacid2-Thiazolecarboxylic acid, 5-(1-methylethyl)-
DB-083000CS-0342471EN300-123635
Database identifiers
- CAS
1179337-78-0- PubChem CID
- 20073044
- DTXSID
DTXSID30602157- EC Number
- 877-344-0
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 161
Physicochemical properties
- storage temp.
- -20 °C · Sealed in dry,Store in freezer, under -20°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P313-P337+P313-P362-P403+P233-P405-P501
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P313-P337+P313-P362-P403+P233-P405-P501
Chemistry & industry
Suppliers9 total
上海爱孜康医药研究有限公司18721109360 · [email protected]
杰达维（上海）医药科技发展有限公司/J & W PharmLab021-64340559 · [email protected]
合肥恩立医药科技有限公司0551-66399836 18955197623 · [email protected]
上海寰川实业有限公司021-61478794 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
砌块化学科技（上海）有限公司021-20432219 13918097649 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
上海智乾生物科技有限公司[email protected]
Wuhan Han Sheng New Material Technology Co.，Ltd+86-17798174412 · [email protected]
Related reactions
3 records
Compound notes
Loading…