Basic information
- CAS
75907-55-0- Standard SMILES
COc1ccc(-c2cc(N)sn2)cc1- InChIKey
MYSVJRIBRLABRU-UHFFFAOYSA-N- Molecular formula
- C10H10N2OS
- Average molar mass
- 206.27 g/mol
- Monoisotopic mass
- 206.05138394
Names & identifiers
- Preferred name
- 3-(4-Methoxyphenyl)isothiazol-5-amine
- IUPAC
- 3-(4-methoxyphenyl)-1,2-thiazol-5-amine
- English name
- 3-(4-Methoxyphenyl)isothiazol-5-aMine
- Molecular formula
- C10H10N2OS
- Molecular weight
- 206.26
Names & synonyms
3-(4-Methoxyphenyl)isothiazol-5-amine75907-55-03-(4-Methoxyphenyl)-1,2-thiazol-5-amineSCHEMBL1840176DTXSID00504114MYSVJRIBRLABRU-UHFFFAOYSA-N3-(4-methoxyphenyl)isothiazol-5-ylamine5-Isothiazolamine, 3-(4-methoxyphenyl)-3-(5-Nitro-cyclohex-1-enyl)-acrylic acid
Database identifiers
- CAS
75907-55-0- PubChem CID
- 12603880
- DTXSID
DTXSID00504114- Nikkaji
- J3.475.413F
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 76.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 183
Physicochemical properties
- storage temp.
- 2 · 2-8°C
Chemistry & industry
Suppliers3 total
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
嘉兴市德亿化工有限公司86-0573-85866609 18367600069 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
Related reactions
1 records
Compound notes
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