6-Chloro-2-oxo-2H-chromene-3-carboxylic acid

HCID 271643CAS 883-92-1

Completing data — usually done within a minute

Substructure searchFind similar structures

Basic information

Standard SMILES
O=C(O)c1cc2cc(Cl)ccc2oc1=O
InChIKey
FOEGEQQPOKZIAB-UHFFFAOYSA-N
Molecular formula
C10H5ClO4
Average molar mass
224.599 g/mol
Monoisotopic mass
223.98763632

Names & identifiers

Preferred name
6-Chloro-2-oxo-2H-chromene-3-carboxylic acid
IUPAC
6-Chloro-2-oxo-2H-1-benzopyran-3-carboxylic acid
English name
6-Chloro-2-oxo-2H-chromene-3-carboxylic acid
Molecular formula
C10H5ClO4
Molecular weight
224.6

Names & synonyms

6-Chloro coumarin-3-carboxylic acidCHEMBRDG-BB 3013962ART-CHEM-BB B013962TIMTEC-BB SBB0044356-chloro-2-oxochromene-3-carboxylicaci6-chloro-2-oxo-3-chromenecarboxylic acid6-chloro-2-oxochromene-3-carboxylic acid6-chloro-2-oxo-chromene-3-carboxylic acid6-chloro-2-keto-chromene-3-carboxylic acid6-Chlorocoumarin-3-carboxylic acid 98%HPLC

Database identifiers

CAS
883-92-1
PubChem CID
271643
DTXSID
DTXSID50297327
ChEMBL
CHEMBL1414071
EC Number
840-472-2
Nikkaji
J687.685D

Properties

Physicochemical properties

Melting point
193 °C · 193 °C(Solv: ethanol (64-17-5))
Boiling point
426.5 · 426.5±45.0 °C(Predicted)
Density
1.612 · 1.612±0.06 g/cm3(Predicted)
pka
1.51 · 1.51±0.20(Predicted)
Symbol(GHS)
7 · GHS07
Signal word
Warning

Safety & regulation

Safety data

hs_code
29339900
risk_code
34
Signal word
Warning
Symbol(GHS)
GHS07
hazard_code
Xi
safety_code
26-36/37/39-45

Chemistry & industry

Upstream & downstream products

Suppliers29 total

北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Syntechem Co.,Ltd[email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
山东李比希生物医药科技有限公司17866677155 · [email protected]

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Linked notes

Loading…