Basic information
- CAS
118-44-5- Standard SMILES
CCNc1cccc2ccccc12- InChIKey
KDFFXYVOTKKBDI-UHFFFAOYSA-N- Molecular formula
- C12H13N
- Average molar mass
- 171.24 g/mol
- Monoisotopic mass
- 171.10479942
Names & identifiers
- Preferred name
- N-Ethyl-1-naphthalenamine
- IUPAC
- N-ethylnaphthalen-1-amine
- English name
- N-Ethyl-1-naphthylamine
- Molecular formula
- C12H13N
- Molecular weight
- 171.24
Names & synonyms
N-Ethyl-1-naphthylamine118-44-51-Naphthalenamine, N-ethyl-N-ethyl-1-naphthalenamine1-(Ethylamino)naphthalene1-Naphthylamine, N-ethyl-Ethyl(1-naphthyl)amine2-(Ethylamino)naphthaleneN-Ethyl-alpha-naphthylamineEthyl-.alpha.-naphthylamineN-Ethyl-.alpha.-naphthylamineEthyl-alpha-naphthylamine
Show more names
1-NaphtylethylamineN-Ethyl-1-naphthylaMN-Ethyl--naphthylaminEthyl-a-naphthylamineN-ETHYL-1-NAPTHYLAMINEN-Ethyl-1-naphtylamineN-ETHYL-A-NAPHTHYLAMINEN-Ethyl-α-naphthylamine
A5859QV29XNSC 8636NSC-8636EINECS 204-250-3AI3-20321DTXSID8059473N-ETHYL-1-AMINONAPHTHALENERefChem:829826
Database identifiers
- CAS
118-44-5- PubChem CID
- 67043
- DTXSID
DTXSID8059473- UNII
- A5859QV29X
- EC Number
- 204-250-3
- Nikkaji
- J40.487J
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 155
Experimental & physicochemical properties
SpringerMaterials PropertiesOptical coefficient
Physicochemical properties
- Melting point
- 164 · 164-165 °C (decomp)(Solv: ethyl ether (60-29-7))
- Boiling point
- 175 · 175-176 °C/15 mmHg (lit.)
- Density
- 1.065 g/mL · 1.065 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.644(lit.)
- Flash point
- 230 °F · >230 °F
- storage temp.
- 2 · 2-8°C
- pka
- 5.12 · 5.12±0.20(Predicted)
- form
- liquid
- color
- Colourless
- BRN
- 2207404 · 2207404
- InChI
- 1S/C12H13N/c1-2-13-12-9-5-7-10-6-3-4-8-11(10)12/h3-9,13H,2H2,1H3
- InChIKey
- KDFFXYVOTKKBDI-UHFFFAOYSA-N
- SMILES
- CCNc1cccc2ccccc12
- CAS DataBase Reference
- 118 · 118-44-5(CAS DataBase Reference)
- FDA UNII
- 5859 QV29X · A5859QV29X
- NIST Chemistry Reference
- 1 · 1-Naphthalenamine, N-ethyl-(118-44-5)
- EPA Substance Registry System
- 1 · 1-Naphthalenamine, N-ethyl- (118-44-5)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 6 · GHS06,GHS09
- Signal word
- Danger
- Hazard statements
- 302 · H302-H311-H411
- Precautionary statements
- 264 · P264-P270-P280-P273-P301+P312-P330-P302+P352-P312-P361+P364-P391-P405-P501
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- Hazard Codes
- Xn
- Risk Statements
- 20 · 20/21/22
- Safety Statements
- 36 · 36/37
- RIDADR
- 2810 · 2810
- WGK Germany
- 2 · 2
- F
- 8 · 8-10-23
- TSCA
- TSCA listed
- HS Code
- 29214500 · 29214500
- Storage Class
- 10 · 10 - Combustible liquids
- Hazard Classifications
- 4 OralAquatic · Acute Tox. 4 OralAquatic Acute 1
Safety & regulation
GHS classification
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P262, P264, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P316, P317, P321, P330, P361+P364, P362+P364, P391, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 186 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- F
- 8-10-23
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 2
- tsca
- TSCA listed
- ridadr
- 2810
- hs_code
- 29214500
- risk_code
- 20/21/22
- Signal word
- Danger
- Symbol(GHS)
- GHS06,GHS09
- hazard_code
- Xn
- safety_code
- 36/37
- Storage Class
- 10 - Combustible liquids
- Hazard statements
- H302-H311-H411
- Hazard Classifications
- Acute Tox. 4 OralAquatic Acute 1
- Precautionary statements
- P264-P270-P280-P273-P301+P312-P330-P302+P352-P312-P361+P364-P391-P405-P501
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1-Naphthalenamine, N-ethyl-: ACTIVE
Applications
UsesN-Ethyl-1-naphthylamine was used in characterization of nitrite-dependent genotoxins and tumour promoter-like substances in fermented fish sauce by cross coupling reaction. It may be used in the identification of triazenes metabolites in urine by coupling and forming colored azo dyes.
UsesIntermediate.
Upstream & downstream products
Downstream products
Suppliers39 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
江苏普乐司生物科技有限公司0513-66017706 18551496367 · [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]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海隆盛化工有限公司58099637 13585536065 · [email protected]
玛雅试剂+86 (573) 82222445 (0)18006601000 452520369 · [email protected]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
北京京土恒盛化工科技有限公司00-13911456598 13911456598 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
安徽科迪达化工有限公司0554-2106669 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
上海嵩爰化工科技有限公司010-1234567 18521000990 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [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]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
启源（广东）医药化工有限公司18026564465 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
山东西亚化学有限公司4009903999 13395398332 · [email protected]
广东翁江化学试剂有限公司0751-2886750 13927877953 · [email protected]
山东小野化学股份有限公司0539-6362799 20）
盼得（上海）国际贸易有限公司80159919 18662931292 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
厦门盈融达化工有限公司+86-0592-6210733 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
Aladdin Scientific[email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
上海宝杨宝欣生物科技有限公司021-56698539 19921169802 · [email protected]
重庆卡兰医药有限公司[email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +8619957148339 · [email protected]
江苏润丰合成科技有限公司0513-66017678 18551497631 · [email protected]
上海珅桔化工有限公司13167128868 13248068001 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
Related reactions
9 records
Compound notes
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