Basic information
- CAS
490-63-1- Standard SMILES
COc1cc(C=O)c(C(=O)O)cc1OC- InChIKey
CXANNUKKXKKTKG-UHFFFAOYSA-N- Molecular formula
- C10H10O5
- Average molar mass
- 210.18 g/mol
- Monoisotopic mass
- 210.05282342
Names & identifiers
- Preferred name
- 2-Formyl-4,5-dimethoxybenzoic acid
- IUPAC
- 2-formyl-4,5-dimethoxybenzoic acid
- English name
- 2-FORMYL-4,5-DIMETHOXY-BENZOIC ACID
- Molecular formula
- C10H10O5
- Molecular weight
- 210.18
Names & synonyms
2-formyl-4,5-dimethoxybenzoic acid490-63-1DTXSID00428346RefChem:261150DTXCID803791802-formyl-4,5-dimethoxy-benzoic AcidMFCD06739602Benzoic acid, 2-formyl-4,5-dimethoxy-m-OpiansaureSCHEMBL41694674,5-Dimethoxyphthalaldehydic acidCXANNUKKXKKTKG-UHFFFAOYSA-N
Show more names
2-formyl-4,5-dimethoxybenzoicacidAAA49063AKOS005209319BS-16860SY211165CS-0150608D70705EN300-317525
Database identifiers
- CAS
490-63-1- PubChem CID
- 7176207
- DTXSID
DTXSID00428346
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 240
Physicochemical properties
- storage temp.
- Inert atmosphere,Room Temperature
- Appearance
- White to off-white Solid
- CAS DataBase Reference
- 490 · 490-63-1
- Symbol(GHS)
- 8 · GHS08
- Signal word
- Warning
- Hazard statements
- 227 · H227
- Precautionary statements
- 501 · P501-P210-P280-P370+P378-P403+P235
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22
Safety & regulation
Safety data
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS08
- hazard_code
- Xn
- Hazard statements
- H227
- Precautionary statements
- P501-P210-P280-P370+P378-P403+P235
Chemistry & industry
Suppliers18 total
上海腾准生物科技有限公司19821570922 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [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]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
上海睿升化工科技有限公司15026594951 · [email protected]
河南威梯希化工科技有限公司0371-53370800 18037197114 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
河南普赛化工产品有限公司0371-60919097 15378766539 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
上海诚合医药科技有限公司021-021-54382182 18601603956 · [email protected]
苏州诺行贸易有限公司0512-65816829 18662214788 · [email protected]
河南利恩化工产品有限公司03716091-9097 13383857418 · [email protected]
Related reactions
6 records
Compound notes
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