Basic information
- CAS
18093-05-5- Standard SMILES
COc1cc(Cl)c(C=O)cc1OC- InChIKey
KTLBJNXLHDMIRZ-UHFFFAOYSA-N- Molecular formula
- C9H9ClO3
- Average molar mass
- 200.62 g/mol
- Monoisotopic mass
- 200.02402183
Names & identifiers
- Preferred name
- 2-Chloro-4,5-dimethoxybenzaldehyde
- IUPAC
- 2-chloro-4,5-dimethoxybenzaldehyde
- English name
- 2-Chloroveratraldehyde
- Molecular formula
- C9H9ClO3
- Molecular weight
- 200.62
Names & synonyms
2-Chloro-4,5-dimethoxybenzaldehydeDTXSID00299376RefChem:86208DTXCID50250513963-046-9KTLBJNXLHDMIRZ-UHFFFAOYSA-N18093-05-52-Chloro-4,5-dimethoxy-benzaldehydeMFCD00461433Benzaldehyde, 2-chloro-4,5-dimethoxy-6-Chloroveratraldehyde6-chloro-3,4-dimethoxybenzaldehyde
Show more names
2-chloro-4,5-dimethoxybenzaldehyde(SALTDATA: FREE)6-chloro-3,4-dimethoxybenzaldehyde (2-Chloro-3,4-dimethoxybenzaldehyde)
NSC1298256-Chloro-veratraldehydeSCHEMBL1049563SCHEMBL62106123,4 dimethoxy-6-chlorobenzaldehyde4,5-dimethoxy-2-chlorobenzaldehydeTAA09305AC1567
Database identifiers
- CAS
18093-05-5- PubChem CID
- 279351
- DTXSID
DTXSID00299376- EC Number
- 963-046-9
- Nikkaji
- J3.771.396A
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 174
Physicochemical properties
- Melting point
- 144 °C · 144 °C
- Boiling point
- 303.6 · 303.6±37.0 °C(Predicted)
- Density
- 1.245 · 1.245±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
- HazardClass
- IRRITANT
- HS Code
- 2913000090 · 2913000090
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 (100%): 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)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2913000090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_class
- IRRITANT
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Suppliers15 total
韶远科技（上海）有限公司021-50795510 4000665055 · [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]
南京代盟化工有限公司02566880956 · [email protected]
河南利恩化工产品有限公司0371-63357898 15378766539 · [email protected]
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
上海颖心实验室设备有限公司021-021-59178156 15300768757 · [email protected]
Shanghai Acmec Biochemical Technology Co., Ltd.+86-18621343501 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 19370895928 · [email protected]
Accela ChemBio Inc.+1-858-6993322 +86-18019713315 · [email protected]
SHANGHAI KEAN TECHNOLOGY CO., LTD.+8613817748580 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
上海鼓臣生物技术有限公司021-34675735 19147740836 · [email protected]
Related reactions
9 records
Compound notes
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