Cas no 685902-48-1 (tert-butyl 5-formylnaphthalen-2-ylcarbamate)
685902-48-1 structure
Product Name:tert-butyl 5-formylnaphthalen-2-ylcarbamate
CAS No:685902-48-1
MF:C16H17NO3
MW:271.311084508896
CID:971448
PubChem ID:53432538
Update Time:2025-04-19
tert-butyl 5-formylnaphthalen-2-ylcarbamate Chemical and Physical Properties
Names and Identifiers
-
- tert-butyl 5-formylnaphthalen-2-ylcarbamate
- TERT-BUTYL (5-FORMYL-2-NAPHTHYL)CARBAMATE
- tert-butyl N-(5-formylnaphthalen-2-yl)carbamate
- DTXSID00700558
- BENZYLALPHA-D-GLUCOPYRANOSIDE
- 685902-48-1
- tert-Butyl (5-formylnaphthalen-2-yl)carbamate
- TERT-BUTYL(5-FORMYL-2-NAPHTHYL)CARBAMATE
-
- Inchi: 1S/C16H17NO3/c1-16(2,3)20-15(19)17-13-7-8-14-11(9-13)5-4-6-12(14)10-18/h4-10H,1-3H3,(H,17,19)
- InChI Key: NCUHELDNTPDJQW-UHFFFAOYSA-N
- SMILES: O(C(NC1C=CC2C(C=O)=CC=CC=2C=1)=O)C(C)(C)C
Computed Properties
- Exact Mass: 271.12100
- Monoisotopic Mass: 271.12084340g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
- Complexity: 361
- 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: 3.2
- Topological Polar Surface Area: 55.4?2
Experimental Properties
- PSA: 55.40000
- LogP: 4.07230
tert-butyl 5-formylnaphthalen-2-ylcarbamate Related Literature
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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