Basic information
- CAS
38620-92-7- Standard SMILES
c1ccc(Cc2cccc3ccccc23)cc1- InChIKey
KTHUKEZOIFYPEH-UHFFFAOYSA-N- Molecular formula
- C17H14
- Average molar mass
- 218.29 g/mol
- Monoisotopic mass
- 218.10955045
Names & identifiers
- Preferred name
- 1-Benzylnaphthalene
- IUPAC
- 1-benzylnaphthalene
- English name
- BENZYLNAPHTHALENES
- Molecular formula
- C17H14
- Molecular weight
- 218.29306
Names & synonyms
1-Benzylnaphthalene611-45-0DTXSID20870686RefChem:430029DTXCID20818386661-210-1Naphthalene, 1-(phenylmethyl)-1-benzyl-naphthalene38620-92-71-(phenylmethyl)naphthalenebenzylnaphthalene(PHENYLMETHYL)NAPHTHALENE
Show more names
BENZYLNAPHTHALENESBENZYLNAPHTHALENES(MIXED,UNSPECIFIED)
1-Benzyl-naphthalin1-Benzylnaphthalene, 97%phenyl-I+/--naphthylmethaneSCHEMBL147085SCHEMBL810385SCHEMBL1141385SCHEMBL1141388SCHEMBL1395580
Database identifiers
- CAS
38620-92-7、611-45-0- PubChem CID
- 38074
- DTXSID
DTXSID20870686- EC Number
- 661-210-1
- Nikkaji
- J94.939F
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 226
Experimental & physicochemical properties
Kovats Retention Index
1962.7
332.88
Safety & regulation
GHS classification
GHS Classification
Warning
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]；H410 (100%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]
P273, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 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 CategoriesAquatic Acute 1 (100%)；Aquatic Chronic 1 (100%)
Chemistry & industry
Suppliers6 total
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
上海贝万塔生物科技有限公司021-67187366 19901745723 · [email protected]
上海智溯科生物科技有限公司021-58056897 15399714481 · [email protected]
上海甄准生物科技有限公司18019219489 18901678489 · [email protected]
南京世洲生物科技有限公司17301488900 · [email protected]
菏泽书颖生物科技有限公司18553078733 · [email protected]
Related reactions
2 records
Compound notes
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