Basic information
- Standard SMILES
CCCCN(C=O)CCCC- InChIKey
NZMAJUHVSZBJHL-UHFFFAOYSA-N- Molecular formula
- C9H19NO
- Average molar mass
- 157.25 g/mol
- Monoisotopic mass
- 157.14666423
Names & identifiers
- Preferred name
- N,N-Dibutylformamide
- IUPAC
- N,N-dibutylformamide
- English name
- N,N-Dibutylformamide
- Molecular formula
- C9H19NO
- Molecular weight
- 157.25
Names & synonyms
N,N-DIBUTYLFORMAMIDE761-65-9DibutylformamideFormamide, N,N-dibutyl-N,N-Di-n-butylformamideFormamide, N,N-di-n-butyl-Dibutylamid kyseliny mravenciEINECS 212-090-0NSC 404525AI3-18810Dibutylamid kyseliny mravenci [Czech]formamide, dibutyl-
Show more names
n,n-dibutyl-formamidN,N-Di-n-butyLdlbutylformamideN-Formyldibutylaminen,n-di-n-butyl-formamidN,N-Dibutylformamide >
NSC-404525BRN 0636100DTXSID3022114UNII-4315805S5N4-04-00-00565 (Beilstein Handbook Reference)4315805S5NEC 212-090-0DI(N-BUTYL)FORAMIDE, N,N-
Database identifiers
- CAS
761-65-9- PubChem CID
- 12975
- DTXSID
DTXSID3022114- UNII
- 4315805S5N
- EC Number
- 212-090-0
- Nikkaji
- J49.547F
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 85
Experimental & physicochemical properties
Physical DescriptionColorless liquid; [Alfa Aesar MSDS]
Kovats Retention Index
1310；1310；1319
1742；1773；1746；1767；1767；1744
Physicochemical properties
- Melting point
- -30 °C · <-30°C
- Boiling point
- 120 °C15 · 120 °C15 mm Hg(lit.)
- Density
- 0.864 g/mL · 0.864 g/mL at 25 °C(lit.)
- vapor pressure
- 1 mm · <1 mm Hg ( 20 °C)
- refractive index
- 20 · n20/D 1.44(lit.)
- Flash point
- 213 °F · 213 °F
- storage temp.
- 2 · 2-8°C
- form
- clear liquid
- pka
- -0.44 · -0.44±0.70(Predicted)
- Specific Gravity
- 0.864 · 0.864
- color
- Colorless to Light yellow
- Water Solubility
- Insoluble in water.
- BRN
- 636100 · 636100
- InChI
- 1S/C9H19NO/c1-3-5-7-10(9-11)8-6-4-2/h9H,3-8H2,1-2H3
- InChIKey
- NZMAJUHVSZBJHL-UHFFFAOYSA-N
- SMILES
- [H]C(=O)N(CCCC)CCCC
- LogP
- 2 at · 2 at 23℃
- CAS DataBase Reference
- 761 · 761-65-9(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 4315805 S5N · 4315805S5N
- NIST Chemistry Reference
- Formamide, N,N-dibutyl-(761-65-9)
- EPA Substance Registry System
- N,N-Dibutylformamide (761-65-9)
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 317 · H317
- Precautionary statements
- 280 · P280
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- Hazard Codes
- Xi
- Risk Statements
- 37 · 37-43-36/37/38
- Safety Statements
- 36 · 36/37-37/39-26
- WGK Germany
- 1 · 1
- RTECS
- 1833000 · LQ1833000
- TSCA
- TSCA listed
- HS Code
- 29241990 · 29241990
- Storage Class
- 10 · 10 - Combustible liquids
- Hazard Classifications
- 1 · Skin Sens. 1
- REACH Registrations
- Active
Safety & regulation
GHS classification
GHS Classification
Danger
H302 (77.3%): Harmful if swallowed [Warning Acute toxicity, oral]；H311 (74.6%): Toxic in contact with skin [Danger Acute toxicity, dermal]；H314 (74%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H317 (22.1%): May cause an allergic skin reaction [Warning Sensitization, Skin]；H318 (74%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H412 (76.8%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
P260, P261, P262, P264, P264+P265, P270, P272, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P333+P317, P361+P364, P362+P364, P363, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 181 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Regulatory Information
Status: Active Update: 02-02-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/24019
Formamide, N,N-dibutyl-: Does not have an individual approval but may be used under an appropriate group standard
Hazards Summary
Causes flaccid paralysis without anesthesia and somnolence in intraperitoneal lethal-dose studies of mice and rats; [RTECS] A skin and strong eye irritant; Toxic by ingestion; Reproductive effects observed in experimental animals; [Alfa Aesar MSDS] See Dimethylformamide.
Hazard Classes and CategoriesAcute Tox. 4 (77.3%)；Acute Tox. 3 (74.6%)；Skin Corr. 1C (74%)；Skin Sens. 1 (22.1%)；Eye Dam. 1 (74%)；Aquatic Chronic 3 (76.8%)
Toxicology
Adverse EffectsNeurotoxin - Acute solvent syndrome
Regulatory information
Regulatory Information
Status: Active Update: 02-02-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/24019
Formamide, N,N-dibutyl-: Does not have an individual approval but may be used under an appropriate group standard
Safety data
- PPE
- Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 1
- tsca
- TSCA listed
- rtecs
- LQ1833000
- hs_code
- 29241990
- risk_code
- 37-43-36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 36/37-37/39-26
- Storage Class
- 10 - Combustible liquids
- Hazard statements
- H317
- REACH Registrations
- Active
- Hazard Classifications
- Skin Sens. 1
- Precautionary statements
- P280
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationFormamide, N,N-dibutyl-: ACTIVE
Applications
UsesN,N-dibutylformamide is a pollutant sourcing from aerosols and or exhaust gases in Los Angeles.
Upstream & downstream products
Downstream products
Suppliers50 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]
安徽旺山旺水特种气体有限公司15906197626 · [email protected]
武汉欣扬瑞和化学科技有限公司13720274133 · [email protected]
广州佳途科技股份有限公司81960175 18933936954 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [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]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Syntechem Co.,Ltd[email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
北京索莱宝科技有限公司010-50973130 17801761073 · [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]
湖北广奥生物科技有限公司027-02702759223056 18162699093 · [email protected]
上海瀚香生物科技有限公司177-54423994 17754423994 · [email protected]
上海嘉斯保气体有限公司13218776790 13218776790 · [email protected]
湖北成海化工有限公司027-59220433 18327245847 · [email protected]
湖北微斯汀科技有限公司027-61182895 13367240285 · [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]
上海和宁美生物医药科技有限公司021-18019086215 18019086215 · [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]
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]
武汉卡诺斯科技有限公司153-37111468 15337111468 · [email protected]
盐城奥科联合医药科技有限公司0515-89701588 13770166955 · [email protected]
上海丽康新材料有限公司+86-16631818819 +86-17736933208 · [email protected]
上海将来实业股份有限公司400-0066400 13621662912 · [email protected]
天津奥立非医药技术有限公司18202662021 18522876413 · [email protected]
上海御略医药科技有限公司021-60345187 13671753212 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
常州天瑞医药科技有限公司0519-85386832 13382812559 · [email protected]
湖北巨胜科技有限公司027-59599241 18871490274 · [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]
大连易得瑞化工有限公司15141125520 15141125520 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
湖北玖丰隆化工有限公司13277936479 · [email protected]
湖北军瑞生物科技有限公司13971166412 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
河南誉康卓宁进出口有限公司13393721940 · [email protected]
上海凯米莱铂生物科技有限公司18116465878 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 +86-17392587031 · [email protected]
Related reactions
2 records
Linked notes
Loading…