Cas no 7570-97-0 (2-(benzylsulfanyl)naphthalene)
2-(benzylsulfanyl)naphthalene structure
Product Name:2-(benzylsulfanyl)naphthalene
2-(benzylsulfanyl)naphthalene Chemical and Physical Properties
Names and Identifiers
-
- 2-(benzylsulfanyl)naphthalene
- 2-benzylsulfanylnaphthalene
- 2-NaphSCH2Ph
- 2-naphthyl benzyl sulfide
- benzyl 2-naphthyl sulfide
- benzyl naphth-2-yl sulfide
- NSC99888
- NSC-99888
- DTXSID10295147
- Naphthalene, 2-[(phenylmethyl)thio]-
- SCHEMBL6057087
- 7570-97-0
- QRQPUJRXMQTTLU-UHFFFAOYSA-N
- 2-Naphthyl-benzylsulfid
-
- Inchi： 1S/C17H14S/c1-2-6-14(7-3-1)13-18-17-11-10-15-8-4-5-9-16(15)12-17/h1-12H,13H2
- InChI Key： QRQPUJRXMQTTLU-UHFFFAOYSA-N
- SMILES： S(CC1C=CC=CC=1)C1=CC=C2C=CC=CC2=C1
Computed Properties
- Exact Mass: 250.08200
- Monoisotopic Mass: 250.08162162g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 244
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.2
- Topological Polar Surface Area: 25.3?2
Experimental Properties
- PSA: 25.30000
- LogP: 5.13210
2-(benzylsulfanyl)naphthalene Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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