Basic information
- Standard SMILES
Nc1cccc(C(F)(F)F)n1- InChIKey
NFYYDQMFURPHCC-UHFFFAOYSA-N- Molecular formula
- C6H5F3N2
- Average molar mass
- 162.11 g/mol
- Monoisotopic mass
- 162.04048282
Names & identifiers
- Preferred name
- 2-Amino-6-(trifluoromethyl)pyridine
- IUPAC
- 6-(trifluoromethyl)pyridin-2-amine
- English name
- 2-Amino-6-(trifluoromethyl)pyridine
- Molecular formula
- C6H5F3N2
- Molecular weight
- 162.11
Names & synonyms
2-Amino-6-(trifluoromethyl)pyridine34486-24-3DTXSID00356271RefChem:464703DTXCID10307330636-458-96-(trifluoromethyl)pyridin-2-amineMFCD030938686-(trifluoromethyl)-2-pyridinylamineEN300-614962-Pyridinamine, 6-(trifluoromethyl)-6-(trifluoromethyl)-2-pyridylamine
Show more names
4-(TRIFLUOROMETHYL)PYRIDIN-2-AMINE2-Amino-6-(trifL6-trifluromethylpyridin-2-amine6-trifluoromethyl-2-pyridinamine2-Amino-6-(trifloromethyl)pyridine6-TrifluoroMethyl-pyridin-2-ylaMine
2-amino-6-trifluoromethylpyridine6-(trifluoromethyl)-2-pyridinamineAQ-776/42801241SCHEMBL181081SCHEMBL21855912SCHEMBL305316876-trifluoromethylpyridin-2-aminePBPDHPGJRZUHJW-UHFFFAOYSA-N
Database identifiers
- CAS
34486-24-3- PubChem CID
- 821024
- DTXSID
DTXSID00356271- EC Number
- 636-458-9
- Nikkaji
- J2.152.094B
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 38.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 134
Physicochemical properties
- Melting point
- 85 · 85-89 °C
- Boiling point
- 192.1 · 192.1±40.0 °C(Predicted)
- Density
- 1.368 · 1.368±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2–8 °C
- solubility
- soluble in Methanol
- form
- powder to crystal
- pka
- 3.13 · 3.13±0.24(Predicted)
- color
- Light yellow to Brown to Dark green
- Sensitive
- Hygroscopic
- BRN
- 473259 · 473259
- InChI
- InChI=1S/C6H5F3N2/c7-6(8,9)4-2-1-3-5(10)11-4/h1-3H,(H2,10,11)
- InChIKey
- NFYYDQMFURPHCC-UHFFFAOYSA-N
- SMILES
- C1(N)=NC(C(F)(F)F)=CC=C1
- CAS DataBase Reference
- 34486 · 34486-24-3(CAS DataBase Reference)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 300 · H300-H315-H317-H319-H335
- Precautionary statements
- 280 · P280-P301+P310+P330-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- PPE
- 2 · Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
- Hazard Codes
- T,Xi,Xn
- Risk Statements
- 25 · 25-36/37/38-43-20/21/22
- Safety Statements
- 26 · 26-36/37-45-36
- RIDADR
- 2811 · UN 2811 6.1/PG 1
- WGK Germany
- 3 · 3
- Hazard Note
- Irritant/Toxic
- HazardClass
- IRRITANT, TOXIC
- PackingGroup
- III
- HS Code
- 29333990 · 29333990
- Storage Class
- 6.1 B · 6.1B - Non-combustible acute toxic Cat. 1 and 2very toxic hazardous materials
- Hazard Classifications
- 2 OralEye · Acute Tox. 2 OralEye Irrit. 2Skin Irrit. 2Skin Sens. 1STOT SE 3
- Limited Quantities
- 5 kg · 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Safety & regulation
GHS classification
GHS Classification
Danger
H300 (83.7%): Fatal if swallowed [Danger Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P272, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 49 reports by companies from 8 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 2 (83.7%)
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
- wgk
- 3
- ridadr
- UN 2811 6.1/PG 1
- hs_code
- 29333990
- risk_code
- 25-36/37/38-43-20/21/22
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- hazard_code
- T,Xi,Xn
- hazard_note
- Irritant/Toxic
- safety_code
- 26-36/37-45-36
- hazard_class
- 6.1
- Storage Class
- 6.1B - Non-combustible acute toxic Cat. 1 and 2very toxic hazardous materials
- packing_group
- III
- target organs
- Respiratory system
- Hazard statements
- H300-H315-H317-H319-H335
- Limited Quantities
- 5.0 kg (11 lbs) (solid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
- Hazard Classifications
- Acute Tox. 2 OralEye Irrit. 2Skin Irrit. 2Skin Sens. 1STOT SE 3
- Precautionary statements
- P280-P301+P310+P330-P302+P352-P305+P351+P338
Chemistry & industry
Applications
UsesSubstrate used in a one-pot synthesis of the corresponding 7-aza-indole.
Suppliers50 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海策嵘生物科技有限公司[email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
爱斯特(成都)生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
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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]
石家庄斯迪亚诺精细化工有限公司0311-89250318 13582355795 · [email protected]
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Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
阜新四维卤化物有限公司0418-2260776 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
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常州环灵化工有限公司89803005 18206112582 · [email protected]
嘉兴市艾森化工有限公司0573-85285100 18627885956 · [email protected]
Pure Chemistry Scientific Inc.001-857-928-2050 or 1-888-588-9418 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
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TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
武汉凯美克化学科技有限公司027-87342388 18086026008 · [email protected]
越林试剂021-62960152 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
广州康瑞泰药业有限公司020-82185713,82185709 13418171485 · [email protected]
CEG Chemical Science & Technology Co., Ltd.Mobile:13665161512
东晟凯瑞(上海)医药科技有限公司15800326364 18051538752
北京环宇世纪化学科技有限公司hysj_bj.com
上海将来实业股份有限公司400-0066400 13621662912 · [email protected]
上海将来实业股份有限公司021-61552785 · [email protected]
安徽科迪达化工有限公司0554-2106669 · [email protected]
HBCChem, Inc.+1-510-219-6317 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
上海石洋化工有限公司021-56795766 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
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Related reactions
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