Basic information
- CAS
2489-86-3- Standard SMILES
C=CCc1cccc2ccccc12- InChIKey
RJFCFNWLPJRCLR-UHFFFAOYSA-N- Molecular formula
- C13H12
- Average molar mass
- 168.23 g/mol
- Monoisotopic mass
- 168.09390038
Names & identifiers
- Preferred name
- 1-(2-Propen-1-yl)naphthalene
- IUPAC
- 1-prop-2-enylnaphthalene
- English name
- 1-Allylnaphthalene
- Molecular formula
- C13H12
- Molecular weight
- 168.23
Names & synonyms
2489-86-3Naphthalene, 1-allyl-1-(2-Propen-1-yl)naphthaleneDTXSID00179588RefChem:1054051DTXCID601020791-ALLYLNAPHTHALENE3-(1-Naphthyl)-1-propene1-prop-2-enylnaphthaleneNaphthalene, 1-(2-propenyl)-1-(prop-2-en-1-yl)naphthaleneMFCD00021581
Show more names
1-AL1-ALLYLPHTHALENE1-allyl-naphthalen3-A-NAPHTHYLPROPENE1-Allylnaphthalene >1-enepropylnaphthalene
1-(2-Propenyl)naphthaleneNaphthalene, 1-(2-propen-1-yl)-alpha-AllylnaphthaleneNaphthalene, (2-propenyl)-BRN 19277761-(2-propenyl)-naphthaleneprop-2-enylnaphthalene.alpha.-Allylnaphthalene
Database identifiers
- CAS
2489-86-3- PubChem CID
- 17217
- DTXSID
DTXSID00179588- EC Number
- 876-431-0
- Nikkaji
- J100.299F
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 171
Experimental & physicochemical properties
SpringerMaterials PropertiesDensity
Physicochemical properties
- Boiling point
- 170 °C · 170°C 14mm
- Density
- 1.0228 · 1.0228
- refractive index
- 1.609 · 1.6090-1.6130
- storage temp.
- 2 · 2-8°C
- form
- clear liquid
- color
- Colorless to Yellow
- InChI
- InChI=1S/C13H12/c1-2-6-11-8-5-9-12-7-3-4-10-13(11)12/h2-5,7-10H,1,6H2
- InChIKey
- RJFCFNWLPJRCLR-UHFFFAOYSA-N
- SMILES
- C1(CC=C)=C2C(C=CC=C2)=CC=C1
- CAS DataBase Reference
- 2489 · 2489-86-3(CAS DataBase Reference)
- EWG's Food Scores
- 1 · 1
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- rtecs
- QJ1399900
- hs_code
- 2902.90.9000
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 26-36/37/39
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers91 total
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
爱斯特（成都）生物制药股份有限公司+86-28-85122536 85324413 · [email protected]
武汉科美沃化工有限公司+86-2785736489 +8618171418573 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
郑州鸿晟医药科技有限公司0371-55695890 15637198702 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
郑州研德生物科技有限公司0371-63682289 15538176268 · [email protected]
武汉丰泰威远科技有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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