Basic information
- CAS
3085-53-8- Standard SMILES
Cc1cccc(NC=O)c1- InChIKey
JPXIYUADQNFRCK-UHFFFAOYSA-N- Molecular formula
- C8H9NO
- Average molar mass
- 135.16 g/mol
- Monoisotopic mass
- 135.06841391
Names & identifiers
- Preferred name
- 3'-Methylformanilide
- IUPAC
- N-(3-methylphenyl)formamide
- English name
- 3-Methylformanilide
- Molecular formula
- C8H9NO
- Molecular weight
- 135.16
Names & synonyms
3085-53-8n-(3-methylphenyl)formamide3'-MethylformanilideEINECS 221-398-4DTXSID90184863NSC 62003RefChem:484709DTXCID30107354221-398-43-MethylformanilideFormamide, N-(3-methylphenyl)-N-m-tolylformamide
Show more names
3-MethylformamideN-(3-methylphenyl)methanamide
UM2UR68SAJN-FORMYL-m-TOLUIDINENSC-62003N-(m-tolyl)formamidem-Formotoluididem-MethylformanilideNSC620033-methylphenylformamide
Database identifiers
- CAS
3085-53-8- PubChem CID
- 76518
- DTXSID
DTXSID90184863- UNII
- UM2UR68SAJ
- EC Number
- 221-398-4
- Nikkaji
- J149.381G
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 114
Physicochemical properties
- Melting point
- -18 °C · <-18 °C
- Boiling point
- 165 · 165-167°C 10mm
- Density
- 1.1031 · 1.1031 (rough estimate)
- refractive index
- 1.5589 · 1.5589 (estimate)
- Flash point
- 165 · 165-167°C/10mm
- pka
- 15 · 15.00±0.70(Predicted)
- FDA UNII
- 2 UR68SAJ · UM2UR68SAJ
- Symbol(GHS)
- 6 · GHS06
- Hazard statements
- 301 · H301
- Precautionary statements
- 264 · P264-P270-P301+P310a-P321-P405-P501a
- Risk Statements
- 21 · 21/22
- Safety Statements
- 23 · 23-36/37/39
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 43 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- risk_code
- 21/22
- Symbol(GHS)
- GHS06
- safety_code
- 23-36/37/39
- Hazard statements
- H301
- Precautionary statements
- P264-P270-P301+P310a-P321-P405-P501a
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers22 total
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
阿法埃莎（中国）化学有限公司400-6106006 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
烟台正信新材料科技有限公司13854547682 13854547682 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
北京环宇世纪化学科技有限公司hysj_bj.com
Qingdao Dexin Chemical Co., Ltd+86-15553333686 · [email protected]
陕西缔都医药化工有限公司+86-029-81138252 +86-173 9270 1263 · [email protected]
阳谷荣科商贸有限公司15863541132 · [email protected]
郑州为易化工产品有限公司0371-88888888 qq272369594;2159423853qq · [email protected]
南兴化工（江苏）有限公司0512-66387035 18662433356 · [email protected]
济南荣科药业有限公司18615606162 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
烟台博运生物科技有限公司13793517650 13793517650 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
山东煜昌药业有限公司531-87153728 13805401165 · [email protected]
烟台盛凯伦化学科技有限公司开发区第一分公司13356901049 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
山东碳氢生物化工有限公司13060081947 13060081947 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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