Basic information
- Standard SMILES
CC(=O)Nc1ccc(C)c([N+](=O)[O-])c1- InChIKey
XYTSBFSNPUGBIH-UHFFFAOYSA-N- Molecular formula
- C9H10N2O3
- Average molar mass
- 194.19 g/mol
- Monoisotopic mass
- 194.06914218
Names & identifiers
- Preferred name
- N-(4-Methyl-3-nitrophenyl)acetamide
- IUPAC
- N-(4-methyl-3-nitrophenyl)acetamide
- English name
- N-(4-methyl-3-nitrophenyl)acetamide
- Molecular formula
- C9H10N2O3
- Molecular weight
- 194.19
Names & synonyms
2719-14-4N-(4-Methyl-3-nitrophenyl)acetamidep-Acetotoluidide, 3'-nitro-Acetamide, N-(4-methyl-3-nitrophenyl)-NSC 86673EINECS 220-319-0NSC 202380DTXSID50181656RefChem:162182DTXCID90104147p-Acetotoluidide, 3'-nitro-(8CI)Acetamide, N-(4-methyl-3-nitrophenyl)-(9CI)
Show more names
3'-Nitro-4'-methylacetoanilide4-Methyl-3-nitrophenylacetamideN-(3-Nitro-4-methylphenyl)acetamideN-(4-methyl-3-nitro-phenyl)ethanamide
220-319-04-Methyl-3-nitroacetanilide4'-Methyl-3'-nitroacetanilideMFCD000242773'-Nitro-p-acetotoluidide4-acetamido-2-nitrotolueneN-(4-Methyl-3-nitro-phenyl)acetamide2-Nitro-4-acetamidotoluene
Database identifiers
- CAS
2719-14-4- PubChem CID
- 73133
- DTXSID
DTXSID50181656- ChEMBL
CHEMBL1709263- UNII
- 5X6N2N3HDH
- EC Number
- 220-319-0
- Nikkaji
- J7.901D
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 74.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 237
Physicochemical properties
- Melting point
- 100 · 100-100.5°C
- Boiling point
- 370 · 370.0±30.0 °C(Predicted)
- Density
- 1.289 · 1.289±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 14.21 · 14.21±0.70(Predicted)
- Appearance
- Light yellow to yellow Solid
- FDA UNII
- 5 X6N2N3HDH · 5X6N2N3HDH
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
- Hazard Codes
- Xi
- HS Code
- 2924190090 · 2924190090
Safety & regulation
Safety data
- hs_code
- 2924190090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Chemistry & industry
Applications
Uses3-Methyl-4-nitro-N-acetylbenzeneamine (cas# 2719-14-4) is a compound useful in organic synthesis.
Upstream & downstream products
Downstream products
Suppliers35 total
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
江苏艾康生物医药研发有限公司025-66061636 19370895928 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [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]
Aceschem Inc.+1-817863-6948 +1-(817)863-6948 · [email protected]
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Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
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常州言己生物科技有限公司0519-83556355 18015005120 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
江西弗莱医药科技有限公司15870833005 · [email protected]
嘉兴市浙嘉生物科技有限公司0573-85609002 · [email protected]
郑州汇聚化工有限公司0371-55900031 18137872243 · [email protected]
上海策嵘生物科技有限公司(定制合成实验室)13062833949 · [email protected]
合肥钼凯医药科技有限公司18130062233 · [email protected]
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天津希恩思生化科技有限公司400-6387771-6039 18920764717 · [email protected]
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Changzhou Ansciep Chemical Co., Ltd.+86 519 86305871 · [email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
常州千艾生物科技有限公司051915240519135 13961152745 · [email protected]
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上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 18917919676 · [email protected]
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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]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
菏泽书颖生物科技有限公司18553078733 · [email protected]
Related reactions
3 records
Linked notes
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