Basic information
- CAS
6921-29-5- Standard SMILES
C#CCN(CC#C)CC#C- InChIKey
ZHOBJWVNWMQMLF-UHFFFAOYSA-N- Molecular formula
- C9H9N
- Average molar mass
- 131.17 g/mol
- Monoisotopic mass
- 131.07349929
Names & identifiers
- Preferred name
- Tripropargylamine
- IUPAC
- N,N-bis(prop-2-ynyl)prop-2-yn-1-amine
- English name
- TRIPROPARGYLAMINE
- Molecular formula
- C9H9N
- Molecular weight
- 131.17
Names & synonyms
Tripropargylamine6921-29-5TRI-2-PROPYNYLAMINE2-Propyn-1-amine, N,N-di-2-propynyl-N,N-Di-2-propynyl-2-propyn-1-amineUNII-5E92GFJ1AJ5E92GFJ1AJEINECS 230-038-5NSC 76089Tris(2-propynyl)amineBRN 1740578AI3-27433
Show more names
tri(prop-2-yn-1-yl)aMine(HCequivCCH2)3NtriynepropylamineTrispropargylaminetriprop-2-ynylaMineTripropargylaMine 98%tris(propyn-2-yl)amine
NSC-760894-04-00-01138 (Beilstein Handbook Reference)(HC.$.CCH2)3NDTXSID8022244RefChem:191945DTXCID4022442-Propyn-1-amine, N,N-di-2-propynyl-(9CI)230-038-5
Database identifiers
- CAS
6921-29-5- PubChem CID
- 23351
- DTXSID
DTXSID8022244- ChEMBL
CHEMBL422532- UNII
- 5E92GFJ1AJ
- EC Number
- 230-038-5
- Nikkaji
- J1.844I
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 180
Physicochemical properties
- Boiling point
- 79 · 79-85 °C/11 mmHg (lit.)
- Density
- 0.927 g/mL · 0.927 g/mL at 25 °C (lit.)
- refractive index
- 20 · n20/D 1.484(lit.)
- Flash point
- 135 °F · 135 °F
- storage temp.
- 2 · 2-8°C
- pka
- 2.86 · 2.86±0.50(Predicted)
- form
- powder to lump to clear liquid
- color
- White or Colorless to Light yellow
- InChI
- InChI=1S/C9H9N/c1-4-7-10(8-5-2)9-6-3/h1-3H,7-9H2
- InChIKey
- ZHOBJWVNWMQMLF-UHFFFAOYSA-N
- SMILES
- C(N(CC#C)CC#C)C#C
- CAS DataBase Reference
- 6921 · 6921-29-5
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 5 E92GFJ1AJ · 5E92GFJ1AJ
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 2 · GHS02,GHS07
- Signal word
- Warning
- Hazard statements
- 226 · H226-H315-H319-H335
- Precautionary statements
- 210 · P210-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- PPE
- Eyeshields, Gloves, type ABEK (EN14387) respirator filter
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-27-36/37/39
- RIDADR
- 1993 · UN 1993 3/PG 3
- WGK Germany
- 3 · 3
- RTECS
- 7660000 · YK7660000
- HS Code
- 2921.19 · 2921.19.6190
- HazardClass
- 3.2 · 3.2
- PackingGroup
- III
- Storage Class
- 3 · 3 - Flammable liquids
- Hazard Classifications
- 2 Flam · Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
- Limited Quantities
- 5 L · 5.0 L (1.3 gallons) (liquid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Safety & regulation
GHS classification
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (97.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 44 reports by companies from 4 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
Hazard Classes and CategoriesFlam. Liq. 3 (100%)；Skin Irrit. 2 (100%)；Eye Irrit. 2 (100%)；STOT SE 3 (97.7%)
Safety data
- PPE
- Eyeshields, Gloves, type ABEK (EN14387) respirator filter
- wgk
- 3
- rtecs
- YK7660000
- ridadr
- UN 1993 3/PG 3
- hs_code
- 2921.19.6190
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS02,GHS07
- hazard_code
- Xi
- safety_code
- 26-27-36/37/39
- hazard_class
- 3.2
- Storage Class
- 3 - Flammable liquids
- packing_group
- III
- target organs
- Respiratory system
- Hazard statements
- H226-H315-H319-H335
- Limited Quantities
- 5.0 L (1.3 gallons) (liquid)
- Excepted Quantities
- Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
- Hazard Classifications
- Eye Irrit. 2Flam. Liq. 3Skin Irrit. 2STOT SE 3
- Precautionary statements
- P210-P302+P352-P305+P351+P338
Chemistry & industry
Applications
UsesTripropargylamine is used as pharmaceutical intermediate.
Upstream & downstream products
Downstream products
Suppliers64 total
上海康恩博医药科技有限公司17510465506 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
泰州葛林美克医药科技有限公司15366892466
河南赢创生物科技有限公司16650615803 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]
Syntechem Co.,Ltd[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]
广东元丰化学试剂有限公司0751-2829979 13318593351 · [email protected]
湖北兴琰新材料科技有限公司13129948835 · [email protected]
南京圣亿来化工有限公司19951936396 · [email protected]
Apeloa Pharmaceutical Co., Ltd.+86-0571-87635730 +8615858229168 · [email protected]
北京伊诺凯科技有限公司15652467323 · [email protected]
Shanghai Scibiotron Pharmaceutical Co., Ltd+86-16621589600 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
广东顺奥化学试剂有限公司19928586137 · [email protected]
上海毕得医药科技股份有限公司400-164-7117 18317119277 · [email protected]
上海鑫圭生物科技有限公司15121041756 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
陕西缔都医药化工有限公司+86-29-87569262 +86-15003564040 · [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]
南兴化工（江苏）有限公司0512-66387035 18662433356 · [email protected]
韶远科技（上海）有限公司021-50795510 4000665055 · [email protected]
九鼎化学（上海）科技有限公司4009209199 · [email protected]
泰州葛林美克医药科技有限公司0514-86654616 15366892466 · [email protected]
广东翁江化学试剂有限公司0751-2886766 13927870850 · [email protected]
韶关新润合生物科技有限公司19022763608 19022763608 · [email protected]
上海阿拉丁生化科技股份有限公司6206333 13167063860 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
南京博米尔生物科技有限公司025-83453382-8005 · [email protected]
山东西亚化学有限公司4009903999 13395398332 · [email protected]
上海康满林生物医药有限公司68080707 15021879576 · [email protected]
安徽生源化工有限公司13245113336
上海万千化工有限公司18796480002 18796480002 · [email protected]
河南威梯希化工科技有限公司0371-53732842 13383863444 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 19370895928 · [email protected]
上海琼燕医药科技有限公司086-021-15821262312 15821262312 · [email protected]
南京康满林化工实业有限公司025-83453327 · [email protected]
南京康满林化工实业有限公司025-83697070 · [email protected]
艾览（上海）化工科技有限公司400-668-9898 · [email protected]
上海晶石医药科技有限公司021-000000 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 · [email protected]
TCI Chemicals (India) Pvt. Ltd.[email protected]
Aladdin Scientific[email protected]
南京司凡克化工有限公司025-58699658 13814094318 · [email protected]
常州新星联生物科技有限公司+86-0519-85551759 · [email protected]
Related reactions
2 records
Compound notes
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