Basic information
- CAS
369-36-8- Standard SMILES
Nc1cc([N+](=O)[O-])ccc1F- InChIKey
KJVBJICWGQIMOZ-UHFFFAOYSA-N- Molecular formula
- C6H5FN2O2
- Average molar mass
- 156.11 g/mol
- Monoisotopic mass
- 156.03350562
Names & identifiers
- Preferred name
- 2-Fluoro-5-nitroaniline
- IUPAC
- 2-fluoro-5-nitroaniline
- English name
- 2-Fluoro-5-nitroaniline
- Molecular formula
- C6H5FN2O2
- Molecular weight
- 156.11
Names & synonyms
2-Fluoro-5-nitroanilineEINECS 206-720-3DTXSID7074660KJVBJICWGQIMOZ-UHFFFAOYSA-NSC 51768RefChem:472498DTXCID1039260206-720-3InChI=1/C6H5FN2O2/c7-5-2-1-4(9(10)11)3-6(5)8/h1-3H,8H2369-36-8Benzenamine, 2-fluoro-5-nitro-2-fluoro-5-nitro-aniline
Show more names
uoro-5-nitroaniLFluoronitroaniline12-Fluoro-5-nitroanil6-fluoro-3-nitroaniline2-Fluoro-5-nitroaniline98%2-Fluoro-5-nitroaniline>
2-fluoro-5-nitrophenylamine2-FLUORO-5-NITROBENZENAMINEMFCD000076525-Nitro-2-fluoroaniline2-fluoro-5-nitro anilineAniline, 2-fluoro-5-nitro-1-Amino-2-fluoro-5-nitrobenzene2-amino-4-nitro-fluorbenzene
Database identifiers
- CAS
369-36-8- PubChem CID
- 67785
- DTXSID
DTXSID7074660- ChEMBL
CHEMBL317872- EC Number
- 206-720-3
- Nikkaji
- J208.528C
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 71.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 159
Physicochemical properties
- Melting point
- 97 · 97-100 °C (lit.)
- Boiling point
- 295.5 · 295.5±20.0 °C(Predicted)
- Density
- 1.3822 · 1.3822 (estimate)
- Flash point
- 196 °F · 196 °F
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- form
- Crystalline Powder
- pka
- 1.13 · 1.13±0.10(Predicted)
- color
- Ochre-yellow to light brown
- Water Solubility
- Slightly soluble
- BRN
- 2803491 · 2803491
- InChI
- InChI=1S/C6H5FN2O2/c7-5-2-1-4(9(10)11)3-6(5)8/h1-3H,8H2
- InChIKey
- KJVBJICWGQIMOZ-UHFFFAOYSA-N
- SMILES
- C1(N)=CC([N+]([O-])=O)=CC=C1F
- CAS DataBase Reference
- 369 · 369-36-8(CAS DataBase Reference)
- NIST Chemistry Reference
- 2 · 2-Fluoro-5-nitroaniline(369-36-8)
- EPA Substance Registry System
- 2 · Benzenamine, 2-fluoro-5-nitro- (369-36-8)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 2 · GHS02,GHS07
- Signal word
- Danger
- Hazard statements
- 228 · H228-H315-H319-H335
- Precautionary statements
- 210 · P210-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- PPE
- 3 · Eyeshields, Gloves, type P3 (EN 143) respirator cartridges
- Hazard Codes
- F,Xi
- Risk Statements
- 11 · 11-36/37/38
- Safety Statements
- 16 · 16-26-36
- RIDADR
- 1325 · UN 1325 4.1/PG 2
- WGK Germany
- 3 · 3
- Hazard Note
- Irritant
- HazardClass
- 6.1 · 6.1(b)
- PackingGroup
- III
- HS Code
- 29214210 · 29214210
- Storage Class
- 4.1 B · 4.1B - Flammable solid hazardous materials
- Hazard Classifications
- 2 Flam · Eye Irrit. 2Flam. Sol. 1Skin Irrit. 2STOT SE 3
- Limited Quantities
- 1 Kg · 1.0 Kg (2.2 lbs)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
Safety & regulation
GHS classification
GHS Classification
Danger
H228 (80.4%): Flammable solid [Danger Flammable solids]
P210, P240, P241, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 51 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Sol. 1 (80.4%)
Safety data
- PPE
- Eyeshields, Gloves, type P3 (EN 143) respirator cartridges
- wgk
- 3
- ridadr
- UN 1325 4.1/PG 2
- hs_code
- 29214210
- risk_code
- 11-36/37/38
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS07
- hazard_code
- F,Xi
- hazard_note
- Irritant
- safety_code
- 16-26-36
- hazard_class
- 6.1(b)
- Storage Class
- 4.1B - Flammable solid hazardous materials
- packing_group
- III
- target organs
- Respiratory system
- Hazard statements
- H228-H315-H319-H335
- Limited Quantities
- 1.0 Kg (2.2 lbs)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (500g or 500ml)
- Hazard Classifications
- Eye Irrit. 2Flam. Sol. 1Skin Irrit. 2STOT SE 3
- Precautionary statements
- P210-P302+P352-P305+P351+P338
Chemistry & industry
Applications
UsesIt is employed as pharmaceutical intermediate.
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers100 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
上海赫文斯化工有限公司15721252604 17321035817 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
科瑞迪化学400-821-5857 021-64326257 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [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]
武汉凯威斯科技有限公司86-027-67849912 · [email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
常州安轩化工有限公司13912302692 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海景颜化工科技有限公司13817811078 · [email protected]
嘉兴市艾森化工有限公司0573-85285100 18627885956 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [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]
四川库利南科技有限公司400-1166-196 18981987031 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
常州市辰悦化工科技有限公司+86-0519-85500896 · [email protected]
北京泰亚杰科技有限公司021-33690831-8001 13552411790;18616022633 · [email protected]
上海思域化工科技有限公司86-21-34053660 · [email protected]
赛默飞世尔科技（中国）有限公司800-810-5118 · [email protected]
北京伊诺凯科技有限公司400-810-7969 010-59572699 · [email protected]
TCI AMERICA800-4238616 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
上海贤鼎生物科技有限公司4009209199 · [email protected]
越林试剂021-62960152 · [email protected]
Clearsynth Labs Limited+91-22-26355700 · [email protected]
上海汇凯化学科技有限公司021-61995394 18916691159 · [email protected]
上海将来实业股份有限公司400-0066400 13621662912 · [email protected]
安徽科迪达化工有限公司0554-2106669 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
上海御略医药科技有限公司021-60345187 13671753212 · [email protected]
天津安浩生物科技有限公司[email protected]
杭州杰恒化工有限公司0571-87396432 · [email protected]
南京多隆生物科技有限公司18905173768 · [email protected]
上海洽凡生化科技有限公司+86-021-61654350 · [email protected]
上海嵩爰化工科技有限公司010-1234567 18521000990 · [email protected]
江苏艾康生物医药研发有限公司025-66028182 17714375163 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
AN PharmaTech Co Ltd86(21)68097365 · [email protected]
Nantong Haigine Pharma Technology Co., Ltd0086-513-86266699
成都瑞欧克科技有限公司028-64353063 · [email protected]
Related reactions
86 records
Compound notes
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