Basic information
- CAS
64481-10-3- Standard SMILES
O=Cc1coc2c(Cl)cc(Cl)cc2c1=O- InChIKey
IHCCHRKNCOFDAJ-UHFFFAOYSA-N- Molecular formula
- C10H4Cl2O3
- Average molar mass
- 243.04 g/mol
- Monoisotopic mass
- 241.9537494
Names & identifiers
- Preferred name
- 6,8-Dichlorochromone-3-carboxaldehyde
- IUPAC
- 6,8-dichloro-4-oxochromene-3-carbaldehyde
- English name
- 6,8-Dichloro-3-formylchromone
- Molecular formula
- C10H4Cl2O3
- Molecular weight
- 243.04
Names & synonyms
6,8-Dichlorochromone-3-carboxaldehydeRefChem:538763800-280-164481-10-36,8-Dichloro-4-oxo-4H-chromene-3-carbaldehyde6,8-Dichloro-3-formylchromone6,8-dichloro-4-oxochromene-3-carbaldehydeMFCD00051510CHEMBL854936,8-dichlorochromon-3-aldehyde6,8-Dichloro-4-oxo-4H-1-benzopyran-3-carbaldehyde6,8-dichloro-4-oxo-chromene-3-carbaldehyde
Show more names
AKOS B022467AKOS BBS-00006650TIMTEC-BB SBB003197RARECHEM AK HH 0032LABOTEST-BB LT004533446,8-DICHLORO-3-FORMYLCOUMARIN6,8-Dichloro-3-formyl-4-chromone6,8-Dichloro-3-formylchromone,97%6 8-DICHLORO-3-FORMYLCHROMONE 97%
F2106-01546,8-Dichloro-4-oxo-4H-chromene-3-carbaldehyde, AldrichCPRA834765SCHEMBL57086564H-1-Benzopyran-3-carboxaldehyde, 6,8-dichloro-4-oxo-6,8-Dichloro-3-formyl chromoneDTXSID60334858BDBM50131071
Database identifiers
- CAS
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 327
Physicochemical properties
- Melting point
- 169 · 169-174 °C
- Boiling point
- 396.7 · 396.7±42.0 °C(Predicted)
- Density
- 1.669 · 1.669±0.06 g/cm3(Predicted)
- form
- Crystalline Powder
- color
- Light yellow
- InChI
- 1S/C10H4Cl2O3/c11-6-1-7-9(14)5(3-13)4-15-10(7)8(12)2-6/h1-4H
- InChIKey
- IHCCHRKNCOFDAJ-UHFFFAOYSA-N
- SMILES
- Clc1cc(Cl)c2OC=C(C=O)C(=O)c2c1
- CAS DataBase Reference
- 64481 · 64481-10-3(CAS DataBase Reference)
- UNSPSC Code
- 12352103 · 12352103
- NACRES
- 21 · NA.21
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 3 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (66.7%)
Safety data
- wgk
- 3
- hs_code
- 29329900
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- hazard_note
- Irritant
- safety_code
- 37/39-26
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Chemistry & industry
Suppliers40 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
宁波君龙新材料有限公司0574 88552218 18969899212 · [email protected]
北京诺德恒信化工技术有限公司010-84929330 13811281791 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
上海泰矶林实业有限公司02150630626 17717886015 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
上海泰坦科技股份有限公司4006009262 13023226327 · [email protected]
赛默飞世尔科技（中国）有限公司
Related reactions
2 records
Compound notes
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