Basic information
- CAS
3934-81-4- Standard SMILES
COc1ccc(C(=O)O)c(O)c1O- InChIKey
YGDRPEIHNMXLJM-UHFFFAOYSA-N- Molecular formula
- C8H8O5
- Average molar mass
- 184.15 g/mol
- Monoisotopic mass
- 184.03717336
Names & identifiers
- Preferred name
- 2,3-Dihydroxy-4-methoxybenzoic acid
- IUPAC
- 2,3-dihydroxy-4-methoxybenzoic acid
- English name
- 2,3-Dihydroxy-4-methoxybenzoic acid
- Molecular formula
- C8H8O5
- Molecular weight
- 184.15
Names & synonyms
2,3-Dihydroxy-4-methoxybenzoic acid3934-81-42,3-Dihydroxy-p-anisic acidEINECS 223-511-2NSC-156949UNII-3630629597DTXSID50192560NSC 156949Benzoic acid, 2,3-dihydroxy-4-methoxy-O-PYROCATECHUIC ACID, 4-METHOXY-RefChem:81752DTXCID90115051
Show more names
DIHYDROXY-4-METHOXYBENZOIC ACID,2,3-2 3-DIHYDROXY-4-METHOXYBENZOICACID 95%4-METHOXY-2,3-DIHYDROXYBENZOIC ACID 95%2,3-Dihydroxy-4-methoxybenzoic acid, 10 mM in DMSO
3630629597MFCD000164994-Methoxy-2,3-dihydroxybenzoic acidNSC156949SCHEMBL31891092,3-DIHYDROXY-4-METHOXY BENZOIC ACIDYGDRPEIHNMXorb1683821
Database identifiers
- CAS
3934-81-4- PubChem CID
- 77534
- DTXSID
DTXSID50192560- UNII
- 3630629597
- EC Number
- 223-511-2
- Nikkaji
- J217.772B
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 87 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 193
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Melting point
- 207 · 207-208°C
- Boiling point
- 374.6 · 374.6±42.0 °C(Predicted)
- Density
- 1.499 · 1.499±0.06 g/cm3(Predicted)
- pka
- 3.19 · 3.19±0.13(Predicted)
- LogP
- 1.77 · 1.770 (est)
- FDA UNII
- 3630629597 · 3630629597
- HS Code
- 2918999090 · 2918999090
Safety & regulation
Safety data
- hs_code
- 2918999090
Chemistry & industry
Applications
Uses2,3-Dihydroxy-4-methoxybenzoic acid is a compound isolated from extracted from sweet cherry fruits (Prunus avium)[1].
Suppliers30 total
成都彼样生物科技有限公司18108052721 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
武汉众志诚生物技术有限公司13628624121 13628604890 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
Aladdin Scientific[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
United Life Science020-82099279 18988941402 · [email protected]
武汉市皇臻生物化工有限公司13795480948 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
武汉天植生物技术有限公司18607101326 15172504745 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
陕西缔都医药化工有限公司029-81154043 17391733319 · [email protected]
上海康恩博医药科技有限公司400-1388-521 17510465506 · [email protected]
上海哲研生物科技有限公司18017610038 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
广州瑞芯康化工产品有限责任公司18027422796 · [email protected]
上海众泽川医药科技有限公司25888888 15021253307 · [email protected]
上海锋基医药科技有限公司15555063509 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
重庆卡兰医药有限公司[email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
江苏艾康生物医药研发有限公司17714375163 · [email protected]
上海锐谱医药科技有限公司15895968936 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
12 records
Compound notes
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