Basic information
- CAS
23602-61-1- Standard SMILES
O=Cc1ccc(Cl)c(Cl)c1O- InChIKey
WSUWZPYQCSWACI-UHFFFAOYSA-N- Molecular formula
- C7H4Cl2O2
- Average molar mass
- 191.01 g/mol
- Monoisotopic mass
- 189.9588348
Names & identifiers
- Preferred name
- 3,4-Dichloro-2-hydroxybenzaldehyde
- IUPAC
- 3,4-dichloro-2-hydroxybenzaldehyde
- English name
- 3,4-Dichloro-2-hydroxybenzaldehyde
- Molecular formula
- C7H4Cl2O2
- Molecular weight
- 191.01
Names & synonyms
3,4-dichloro-2-hydroxybenzaldehyde23602-61-1MFCD131925243,4-Dichloro-2-hydroxy-benzaldehydeBenzaldehyde, 3,4-dichloro-2-hydroxyBenzaldehyde, dichloro-2-hydroxy-Dichlorosalicylaldehyde3,4-dichlorosalicylaldehydeSCHEMBL658824YAA60261AKOS014316234DS-8209
Show more names
Benzaldehyde, 3,4-dichloro-2-hydroxy-CS-0060317P16831EN300-1249144Z1255432815
Database identifiers
- CAS
23602-61-1- PubChem CID
- 528386
- EC Number
- 885-050-9
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 151
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
Physicochemical properties
- Melting point
- 97 °C · 97 °C
- Boiling point
- 239.5 · 239.5±35.0 °C(Predicted)
- Density
- 1.547 · 1.547±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- 5.74 · 5.74±0.15(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
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
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers21 total
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
北京依特能化学科技有限责任公司010-59484199 18611897322;18611897322 · [email protected]
济南精合医药科技有限公司0531-88811783 · [email protected]
威海怀信生物科技有限公司15662379806 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466205 15377579727 · [email protected]
上海超岚化工科技中心（原宁波市超明生物科技有限公司）13301662590 · [email protected]
天津瑾昇生物医药科技有限责任公司13820634634 18622687818 · [email protected]
上海超岚化工科技中心（原上海巢莱）0-2022843681 15618226720 · [email protected]
南京雅科伦医药科技有限公司025-66096098 3165145969 · [email protected]
米诺化工有限公司0086-15313090952
江苏艾康生物医药研发有限公司025-58859352 15955137747 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466105 15377573527 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
济南新抗医药科技有限公司0531-; 18954137585 · [email protected]
Related reactions
1 records
Compound notes
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