Basic information
- CAS
213831-00-6- Standard SMILES
CC(C)C(=O)Nc1cccc(N)c1- InChIKey
HAUYNXLUELAHAQ-UHFFFAOYSA-N- Molecular formula
- C10H14N2O
- Average molar mass
- 178.23 g/mol
- Monoisotopic mass
- 178.11061307
Names & identifiers
- Preferred name
- N-(3-aminophenyl)-2-methylpropanamide
- IUPAC
- N-(3-aminophenyl)-2-methylpropanamide
- English name
- N-(3-AMINOPHENYL)-2-METHYLPROPANAMIDE
- Molecular formula
- C10H14N2O
- Molecular weight
- 178.23
Names & synonyms
N-(3-aminophenyl)-2-methylpropanamide213831-00-6Propanamide, N-(3-aminophenyl)-2-methyl-N-(3-Aminophenyl)isobutyramideMFCD02258054N-(3-aminophenyl)-2-methyl-PropanamideN-(3-Amino-phenyl)-isobutyramideOprea1_353818Oprea1_568956SCHEMBL520125DTXSID60359369HAUYNXLUELAHAQ-UHFFFAOYSA-N
Show more names
AKOS BB-8165ASISCHEM T31168N-(3-aminophenyl)-2-methyl-propionamide
ALBB-026773BBL000204SBB080087STK001798AKOS000103858VS-00489DB-143704ST45050642
Database identifiers
- CAS
213831-00-6- PubChem CID
- 960757
- DTXSID
DTXSID60359369
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 180
Physicochemical properties
- Hazard Codes
- Xi
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hazard_code
- Xi
- hazard_class
- IRRITANT
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers10 total
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Hangzhou Sage Chemical Co., Ltd.+86057186818502 13588463833 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418684 +86-18949823763 · [email protected]
北京海特乐思克科技有限公司15210893940; 15116916250 · [email protected]
南京世洲生物科技有限公司025-85563444 15850508050 · [email protected]
Related reactions
3 records
Compound notes
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