Basic information
- CAS
87676-07-1- Standard SMILES
COCC(C)Nc1c(C)csc1C- InChIKey
MKTFWDHZGUUGQZ-UHFFFAOYSA-N- Molecular formula
- C10H17NOS
- Average molar mass
- 199.32 g/mol
- Monoisotopic mass
- 199.10308516
Names & identifiers
- Preferred name
- 3-Thiophenamine, N-(2-methoxy-1-methylethyl)-2,4-dimethyl-
- IUPAC
- N-(1-methoxypropan-2-yl)-2,4-dimethylthiophen-3-amine
- English name
- 3-Thiophenamine,N-(2-methoxy-1-methylethyl)-2,4-dimethyl-
- Molecular formula
- C10H17NOS
- Molecular weight
- 199.31308
Names & synonyms
3-Thiophenamine, N-(2-methoxy-1-methylethyl)-2,4-dimethyl-87676-07-1N-(1-methoxypropan-2-yl)-2,4-dimethylthiophen-3-amineZE3K33ATZ8DTXSID9029566N-(2-Methoxy-1-methylethyl)-2,4-dimethyl-3-thiophenamineRefChem:505453DTXCID109566N-(2-METHOXY-1-METHYLETHYL)-2,4-DIMETHYL-3-THIOPHENAMINE, (+-)-899-299-6N-(2-Methoxy-1-methylethyl)-2,4-dimethyl-3-thiophenamine, (+/-)-UNII-ZE3K33ATZ8
Show more names
3-Thiophenamine,N-(2-methoxy-1-methylethyl)-2,4-dimethyl-
SCHEMBL8823858NS00123487EN300-2153541N-(-1-methoxyprop-2-yl)-2,4-dimethyl-3-aminothiophene
Database identifiers
- CAS
87676-07-1- PubChem CID
- 124089
- DTXSID
DTXSID9029566- UNII
- ZE3K33ATZ8
- EC Number
- 899-299-6
- Nikkaji
- J1.597.716G
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 49.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 154
Physicochemical properties
- FDA UNII
- 3 K33ATZ8 · ZE3K33ATZ8
- EPA Substance Registry System
- 3 · 3-Thiophenamine, N-(2-methoxy-1-methylethyl)-2,4-dimethyl- (87676-07-1)
- TSCA
- TSCA listed
Safety & regulation
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information3-Thiophenamine, N-(2-methoxy-1-methylethyl)-2,4-dimethyl-: ACTIVE
Suppliers1 total
河北药成医药科技有限责任公司19903117580 19903117510 · [email protected]
Related reactions
1 records
Compound notes
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