Basic information
- CAS
94-68-8- Standard SMILES
CCNc1ccccc1C- InChIKey
MWOUGPLLVVEUMM-UHFFFAOYSA-N- Molecular formula
- C9H13N
- Average molar mass
- 135.21 g/mol
- Monoisotopic mass
- 135.10479942
Names & identifiers
- Preferred name
- Benzenamine, N-ethyl-2-methyl-
- IUPAC
- N-ethyl-2-methylaniline
- English name
- N-Ethyl-o-toluidine
- Molecular formula
- C9H13N
- Molecular weight
- 135.21
Names & synonyms
N-Ethyl-o-toluidineN-Ethyl-2-methylaniline94-68-82-(Ethylamino)tolueneBenzenamine, N-ethyl-2-methyl-o-Methyl-N-ethylaniline1-(Ethylamino)-2-methylbenzeneo-TOLUIDINE, N-ETHYL-NSC 8888EINECS 202-354-3DTXSID1059107RefChem:561986
Show more names
ETHYL-O-TOLUIDINEN-ETHYL-2-TOLUIDINEN-ETHYL-2-AMINOTOLUENEN-Ethyl-o-toluidine>N- ethyl o-methylamine
o-Toluidine, N-ethyl-(8CI)DTXCID2048905202-354-3InChI=1/C9H13N/c1-3-10-9-7-5-4-6-8(9)2/h4-7,10H,3H2,1-2H2-EthylaminotolueneN-Ethyl-2-methylbenzenamineMFCD00026695Aniline, N-ethyl-2-methyl-
Database identifiers
- CAS
94-68-8- PubChem CID
- 7201
- DTXSID
DTXSID1059107- UNII
- EJ6BYK4C2E
- EC Number
- 202-354-3
- Nikkaji
- J46.548H
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 90.7
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Physicochemical properties
- Melting point
- -6.87 °C · -6.87°C (estimate)
- Boiling point
- 218 °C · 218 °C
- Density
- 0.938 g/mL · 0.938 g/mL at 25 °C(lit.)
- vapor pressure
- 1 hPa · 1 hPa (20 °C)
- refractive index
- 1.546 · 1.546-1.548
- Flash point
- 88 °C · 88 °C
- storage temp.
- 30 °C · Store below +30°C.
- solubility
- 1 g/l · 1g/l
- form
- Oil
- pka
- 1 · pK1:4.92(+1) (25°C)
- color
- Colourless
- explosive limit
- 1.2 · 1.2-5.9%(V)
- Odor Threshold
- 0.026 ppm · 0.026ppm
- Water Solubility
- insoluble
- BRN
- 2689722 · 2689722
- Major Application
- hematologyhistology
- InChI
- 1S/C9H13N/c1-3-10-9-7-5-4-6-8(9)2/h4-7,10H,3H2,1-2H3
- InChIKey
- MWOUGPLLVVEUMM-UHFFFAOYSA-N
- SMILES
- CCNc1ccccc1C
- CAS DataBase Reference
- 94 · 94-68-8(CAS DataBase Reference)
- NIST Chemistry Reference
- -2 · Benzenamine, N-ethyl-2-methyl-(94-68-8)
- EPA Substance Registry System
- -2 · N-Ethyl-2-methylaniline (94-68-8)
- UNSPSC Code
- 12352116 · 12352116
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 6 · GHS06,GHS07,GHS08
- Signal word
- Danger
- Hazard statements
- 300 · H300+H310+H330-H301+H311+H331-H315-H319-H335-H227-H300-H310-H330-H373
- Precautionary statements
- 301 · P301+P310a-P304+P340-P320-P330-P501a-P260-P262-P264-P270-P271-P284-P301+P310+P330-P302+P352+P310+P361+P364-P304+P340+P310-P305+P351+P338+P337+P313-P403+P233-P405-P501-P261-P280-P301+P310-P305+P351+P338-P311
- target organs
- Respiratory system
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- Hazard Codes
- T
- Risk Statements
- 23 · 23/24/25-36/37/38
- Safety Statements
- 45 · 45-36/37/39-28A-26
- RIDADR
- 2754 · 2754
- WGK Germany
- 1 · 1
- Autoignition Temperature
- 445 °C · 445 °C
- TSCA
- TSCA listed
- HS Code
- 2921 · 2921 43 00
- HazardClass
- 6.1 · 6.1
- PackingGroup
- II
- Storage Class
- 6.1 A · 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
- Hazard Classifications
- 3 DermalAcute · Acute Tox. 3 DermalAcute Tox. 3 InhalationAcute Tox. 3 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
- Toxicity
- 50 orally · LD50 orally in Rabbit: 2400 mg/kg
- REACH Registrations
- Active
- Limited Quantities
- 100 ml · 100ml (liquid) or 0.5 Kg (solid)
- Excepted Quantities
- Max Inner Pack (1g or 1ml) and Max Outer Pack (500g or 500ml)
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
This chemical does not meet GHS hazard criteria for 3.8% (6 of 158) of reports.
Danger
H301 (95.6%): Toxic if swallowed [Danger Acute toxicity, oral]
P203, P260, P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P308+P316, P316, P318, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 158 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Warning
Hazard information
Regulatory Information
Chemical: Benzenamine, N-ethyl-2-methyl-
REACH registered substance: N-ethyl-o-toluidine (EC: 202-354-3)
Benzenamine, N-ethyl-2-methyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and Categories
Acute Tox. 3 (95.6%)
Flammable liquids - Category 4
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 1
- tsca
- TSCA listed
- ridadr
- 2754
- hs_code
- 2921 43 00
- Toxicity
- LD50 orally in Rabbit: 2400 mg/kg
- risk_code
- 23/24/25-36/37/38
- Signal word
- Danger
- Symbol(GHS)
- GHS06,GHS07,GHS08
- hazard_code
- T
- safety_code
- 45-36/37/39-28A-26
- hazard_class
- 6.1
- Storage Class
- 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
- packing_group
- II
- target organs
- Respiratory system
- Hazard statements
- H300+H310+H330-H301+H311+H331-H315-H319-H335-H227-H300-H310-H330-H373
- Limited Quantities
- 100ml (liquid) or 0.5 Kg (solid)
- Excepted Quantities
- Max Inner Pack (1g or 1ml) and Max Outer Pack (500g or 500ml)
- REACH Registrations
- Active
- Hazard Classifications
- Acute Tox. 3 DermalAcute Tox. 3 InhalationAcute Tox. 3 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
- Autoignition Temperature
- 445 °C
- Precautionary statements
- P301+P310a-P304+P340-P320-P330-P501a-P260-P262-P264-P270-P271-P284-P301+P310+P330-P302+P352+P310+P361+P364-P304+P340+P310-P305+P351+P338+P337+P313-P403+P233-P405-P501-P261-P280-P301+P310-P305+P351+P338-P311
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzenamine, N-ethyl-2-methyl-: ACTIVE
Applications
UsesN-Ethyl-2-methyl-benzenamine is a useful synthetic intermediate. It is used to synthesize N-Ethyl-3-buteno-o-toluidide (E900630). It can be used as a building block of Potent TGR5 Agonists and 2-deoxo-2-phenyl-5-deazaflavins and 2-deoxo-2-phenylflavin-5-oxides as a new class of antitumor agents. N-Ethyl-2-methyl-benzenamine It is also a stain used for proteomics research.Dyes and metabolites.
General DescriptionN-Ethyl-o-toluidine is a versatile dye widely used in biological research, including proteomics, histopathology, and cell function.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
湖北万得化工有限公司15377098680 15377098680 · [email protected]
武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
上海泰矶林实业有限公司02150630626 17717886015 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
Hebei Yanxi Chemical Co., Ltd.+86-17531190177 · [email protected]
北京安司莫森技术有限公司010-82954736 13391601435 · [email protected]
Hangzhou Verychem Science And Technology Co.Ltd+86-86-57188162785 +8613606544505 · [email protected]
衢州明锋化工有限公司0570-3062502 13819002126;13819008176 · [email protected]
淮安嘉目生物科技有限公司0517-83187139 18205232085 · [email protected]
Syntechem Co.,Ltd[email protected]
北京华威锐科化工有限公司0757-86329057 18934348241 · [email protected]
天津中信凯泰化工有限公司022-66880623 · [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]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海泰坦科技股份有限公司4006009262 13023226327 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
湖北广奥生物科技有限公司027-02702759223056 18162699093 · [email protected]
孝感深远化工有限公司15527621225; 15527621225 · [email protected]
山东西亚化学有限公司13355009207 13355009207 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
上海耐士化工科技有限公司400-188-0725 +86 21 34310725 13611771617
天津希恩思生化科技有限公司400 638 7771 · [email protected]
湖南汇百侍生物科技有限公司0731-85526065 13308475853 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
武汉普洛夫生物科技有限公司17612776928 · [email protected]
深圳菲斯生物科技有限公司0755-83725350 13380397412 · [email protected]
重庆星灿医药科技有限公司13594048950 19923294409 · [email protected]
上海爱蝶实业有限公司021-58957966 18930537195 · [email protected]
湖北巨胜科技有限公司027-59599241 18871490274 · [email protected]
上海昕凯医药科技有限公司21-619849051-1 18521059765 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
厦门志信化学有限公司+86-5922680277 +86-13806087780 · [email protected]
昆山中莱特贸易有限公司0512-55170668 13913095008;13770601296 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
北京华威锐科化工科技有限公司89508211 18501085097 · [email protected]
江西伯业医药科技有限公司027-18971341812/18971341812 18971341812 · [email protected]
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上海西格生物科技有限公司021-57810052 18930344717 · [email protected]
湖北齐飞医药化工有限公司027-59322506 18071128681 · [email protected]
Related reactions
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Compound notes
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