Cas no 676133-21-4 (1-Naphthalenol,7-ethyl-1,2,3,4-tetrahydro-,(1R)-(9CI))
676133-21-4 structure
Product Name:1-Naphthalenol,7-ethyl-1,2,3,4-tetrahydro-,(1R)-(9CI)
CAS No:676133-21-4
MF:C12H16O
MW:176.254843711853
CID:966402
PubChem ID:28293872
Update Time:2025-04-19
1-Naphthalenol,7-ethyl-1,2,3,4-tetrahydro-,(1R)-(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1-Naphthalenol,7-ethyl-1,2,3,4-tetrahydro-,(1R)-(9CI)
- 1-Naphthalenecarboxylicacid,7-ethyl
- 7-ethyl-1,2,3,4-tetrahydro-naphthalen-1-ol
- 7-ethyl-1-naphthoic acid
- (R)-7-Ethyl-1,2,3,4-tetrahydronaphthalen-1-ol
- SCHEMBL3170918
- (1R)-7-ethyl-1,2,3,4-tetrahydronaphthalen-1-ol
- AKOS013569419
- 676133-21-4
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- Inchi： 1S/C12H16O/c1-2-9-6-7-10-4-3-5-12(13)11(10)8-9/h6-8,12-13H,2-5H2,1H3/t12-/m1/s1
- InChI Key： AZWULXYNVPIBHD-GFCCVEGCSA-N
- SMILES： O[C@H]1C2C=C(CC)C=CC=2CCC1
Computed Properties
- Exact Mass: 176.12000
- Monoisotopic Mass: 176.120115130g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 167
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.6
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- PSA: 20.23000
- LogP: 2.61870
1-Naphthalenol,7-ethyl-1,2,3,4-tetrahydro-,(1R)-(9CI) Related Literature
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
676133-21-4 (1-Naphthalenol,7-ethyl-1,2,3,4-tetrahydro-,(1R)-(9CI)) Related Products
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