Basic information
- CAS
6274-29-9- Standard SMILES
COc1ccc(N)c(S)c1- InChIKey
QHALDOSHHZPRRB-UHFFFAOYSA-N- Molecular formula
- C7H9NOS
- Average molar mass
- 155.22 g/mol
- Monoisotopic mass
- 155.04048491
Names & identifiers
- Preferred name
- 2-Amino-5-methoxybenzene-1-thiol
- IUPAC
- 2-amino-5-methoxybenzenethiol
- English name
- 2-amino-5-methoxy-benzenethiol
- Molecular formula
- C7H9NOS
- Molecular weight
- 155.22
Names & synonyms
2-amino-5-methoxybenzene-1-thiolRefChem:464628827-221-22-amino-5-methoxybenzenethiol6274-29-92-Amino-5-methoxythiophenol2-amino-5-methoxy-benzenethiol5-methoxy-2-aminothiophenolMFCD128281815-methoxy-2-aminobenzenethiol2-amino-5-methoxy-thiophenolNSC 36967
Show more names
2-Amino-5-methoxythiophenol (>Benzenethiol, 2-aMino-5-Methoxy-2-amino-5 methoxybenzene-1 -thiol2-amino-5-methoxybenzenethiophenol
2-Amino-5-methoxythiophenol (>90%)2-Mercapto-4-methoxyanilineBenzenethiol,2-amino-5-methoxy-Benzenethiol, 2-amino-5-methoxy-NSC36967SCHEMBL774655SCHEMBL299364702-Amino-5-(methoxy)benzenethiol
Database identifiers
- CAS
6274-29-9- PubChem CID
- 235509
- DTXSID
DTXSID20284365- EC Number
- 827-221-2
- Nikkaji
- J1.584.214H
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 36.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 110
Physicochemical properties
- Melting point
- 103 · 103-105 °C(Solv: ethanol (64-17-5))
- Boiling point
- 289.7 · 289.7±20.0 °C(Predicted)
- Density
- 1.209 · 1.209±0.06 g/cm3(Predicted)
- storage temp.
- Hygroscopic, Refrigerator, under inert atmosphere
- solubility
- DMSO (Slightly), Methanol (Slightly)
- form
- Solid
- pka
- 9.01 · 9.01±0.10(Predicted)
- color
- Light Yellow
- Stability
- Unstable in Solution, Unstable in Air
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319-H335-H302+H312+H332-H315
- Precautionary statements
- 280 · P280-P301+P312-P362+P364
- HS Code
- 2930909899 · 2930909899
Safety & regulation
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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- hs_code
- 2930909899
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319-H335-H302+H312+H332-H315
- Precautionary statements
- P280-P301+P312-P362+P364
Chemistry & industry
Applications
Uses2-Amino-5-methoxythiophenol is a chemical reagent used in the synthesis of antibacterial benzothiazepines.
Suppliers40 total
苏州道澜生物医药科技有限公司15952404857 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [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]
北京亿思研科技开发中心010-56645598 13366904824 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
上海思英化工科技有限公司021-64502386 18017349250 · [email protected]
上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
Related reactions
27 records
Compound notes
Loading…