Basic information
- CAS
22618-51-5- Standard SMILES
Cc1ccccc1C1=CCCCC1- InChIKey
CVNBWDMYHUGFDG-UHFFFAOYSA-N- Molecular formula
- C13H16
- Average molar mass
- 172.27 g/mol
- Monoisotopic mass
- 172.12520051
Names & identifiers
- Preferred name
- Cyclohexen-1-yltoluene
- IUPAC
- 1-(cyclohexen-1-yl)-2-methylbenzene
- English name
- cyclohexen-1-yltoluene
- Molecular formula
- C13H16
- Molecular weight
- 172.27
Names & synonyms
Cyclohexen-1-yltoluene22618-51-51-(1-cyclohexen-1-yl)-2-methylbenzeneEINECS 245-131-6DTXSID30177138NSC 102328RefChem:580751DTXCID8099629245-131-61-(cyclohex-1-en-1-yl)-2-methylbenzene1-(cyclohexen-1-yl)-2-methylbenzene2'-Methyl-2,3,4,5-tetrahydro-1,1'-biphenyl
Show more names
1-(O-TOLYL)-1-CYCLOHEXENE1-(2-Methylphenyl)-1-cyclohexene
N8QH5D26SK1-(o-TOLYL)CYCLOHEXENEBenzene,1-(1-cyclohexen-1-yl)-2-methyl-NSC-102328Benzene, 1-(1-cyclohexen-1-yl)-2-methyl-NSC102328UNII-N8QH5D26SKNCIOpen2_001870
Database identifiers
- CAS
22618-51-5- PubChem CID
- 89775
- DTXSID
DTXSID30177138- UNII
- N8QH5D26SK
- EC Number
- 245-131-6
- Nikkaji
- J286.262J
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 190
Physicochemical properties
- Boiling point
- 121 · 121-123 °C(Press: 16 Torr)
- Density
- 0.966 · 0.966±0.06 g/cm3(Predicted)
- FDA UNII
- 8 QH5D26SK · N8QH5D26SK
- Symbol(GHS)
- 7 · GHS07,GHS05
- Signal word
- Danger
- Hazard statements
- 413 · H413-H335-H318-H315
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
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
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS07,GHS05
- Hazard statements
- H413-H335-H318-H315
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P280-P305+P351+P338-P310
Chemistry & industry
Suppliers10 total
广东元丰化学试剂有限公司0751-2829979 13376591640 · [email protected]
广东顺奥化学试剂有限公司19928586137 · [email protected]
南通华祥医药科技有限公司+86-15716293042 15716293042 · [email protected]
广东翁江化学试剂有限公司0751-2886750 13927877953 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13318584237 · [email protected]
杭州泓兮生物科技有限公司15267073089 15267073089 · [email protected]
CD Chemical Group Limited+86-13651442114 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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