Basic information
- CAS
565-77-5- Standard SMILES
CC(C)=C(C)C(C)C- InChIKey
SZFRZEBLZFTODC-UHFFFAOYSA-N- Molecular formula
- C8H16
- Average molar mass
- 112.21 g/mol
- Monoisotopic mass
- 112.12520051
Names & identifiers
- Preferred name
- 2,3,4-Trimethylpent-2-ene
- IUPAC
- 2,3,4-trimethylpent-2-ene
- English name
- 2,3,3-Trimethyl-1-pentene.
- Molecular formula
- 560-23-6
- Molecular weight
- 0
Names & synonyms
2,3,4-trimethylpent-2-eneDTXSID90870618RefChem:441743DTXCID80818322624-230-12,3,4-TRIMETHYL-2-PENTENE565-77-52-Pentene, 2,3,4-trimethyl-MFCD00059214NSC-739432,4-Trimethyl-2-pentene2-Pentene,3,4-trimethyl-
Show more names
2,3,3-Trimethyl-1-pentene.
NSC73943Pentene, trimethyl-XEE3DPT3LBSCHEMBL6708082,3,4-trimethyl-pent-2-eneSCHEMBL3549030SCHEMBL3549031SCHEMBL5604063
Database identifiers
- CAS
565-77-5、61665-19-8- PubChem CID
- 11270
- DTXSID
DTXSID90870618- UNII
- XEE3DPT3LB
- EC Number
- 624-230-1
- Nikkaji
- J96.525A
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 92.6
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 6.5% (3 of 46) of reports.
Danger
H225 (93.5%): Highly Flammable liquid and vapor [Danger Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P301+P316, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P331, 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 46 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesFlam. Liq. 2 (93.5%)
Chemistry & industry
Suppliers20 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海弘顺生物科技有限公司15901914505 · [email protected]
广东百科试剂有限公司13532366769 13686183698 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [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]
天津希恩思生化科技有限公司400 638 7771 · [email protected]
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [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]
上海贤鼎生物科技有限公司021-021-52271985 17721149837 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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