Basic information
- CAS
20197-75-5- Standard SMILES
COC(=O)c1ccc2c(c1)OCCO2- InChIKey
GYUXWAIDEGEMEE-UHFFFAOYSA-N- Molecular formula
- C10H10O4
- Average molar mass
- 194.18 g/mol
- Monoisotopic mass
- 194.0579088
Names & identifiers
- Preferred name
- Methyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate
- IUPAC
- methyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate
- English name
- 2,3-dihydro-1,4-benzodioxine -6-carboxylic acid methyl ester
- Molecular formula
- C10H10O4
- Molecular weight
- 194.18
Names & synonyms
20197-75-5methyl 2,3-dihydro-1,4-benzodioxine-6-carboxylateDTXSID20396639RefChem:353605DTXCID10347498Methyl 1,4-Benzodioxan-6-carboxylatemethyl 2,3-dihydrobenzo[b][1,4]dioxine-6-carboxylate1,4-Benzodioxin-6-carboxylic acid, 2,3-dihydro-, methyl esterMFCD015449072,3-dihydro-1,4-benzodioxin-6-carboxylic acid methyl ester2,3-dihydro-benzo[1,4]dioxine-6-carboxylic acid methyl esterMethyl1,4-Benzodioxan-6-carboxylate
Show more names
1,4-benzodioxan-6-carboxylate2,3-dihydro-1,4-benzodioxine -6-carboxylic acid methyl ester
SCHEMBL668237CHEMBL2435587GYUXWAIDEGEMEE-UHFFFAOYSA-NEBC-12437Methyl 14-Benzodioxan-6-carboxylateSTL253530AKOS000348972AS-31621
Database identifiers
- CAS
20197-75-5- PubChem CID
- 3802178
- DTXSID
DTXSID20396639
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 216
Physicochemical properties
- Boiling point
- 135 · 135-140 °C(Press: 1-2 Torr)
- Density
- 1.242 · 1.242±0.06 g/cm3(Predicted)
- storage temp.
- Inert atmosphere,Room Temperature
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302
- Precautionary statements
- 280 · P280-P305+P351+P338
- HS Code
- 2932990090 · 2932990090
Safety & regulation
Safety data
- hs_code
- 2932990090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers63 total
上海康恩博医药科技有限公司17510465506 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
上海瀚麟生物科技有限公司183-0212-4410 18302124410 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
Aladdin Scientific[email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
常州科化生物科技有限公司0519-68985668 13685222090 · [email protected]
浙江雅辰药物科技股份有限公司13674959855 13674959855 · [email protected]
安徽合诺生物科技有限公司18455579438
Related reactions
11 records
Compound notes
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