Cas no 7475-32-3 ( )
structure
Product Name:
CAS No:7475-32-3
MF:C16H13BrO6
MW:381.174824476242
CID:980206
PubChem ID:344318
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- (3,4-diacetyloxy-7-bromonaphthalen-1-yl) acetate
- AC1L80A5
- NSC401171
- NSC-401171
- 1,2,4-triacetoxy-6-bromonaphthalene
- 7475-32-3
- DTXSID90322400
-
-
- Inchi： 1S/C16H13BrO6/c1-8(18)21-14-7-15(22-9(2)19)16(23-10(3)20)12-5-4-11(17)6-13(12)14/h4-7H,1-3H3
- InChI Key： FHOZUWIOHMSYAE-UHFFFAOYSA-N
- SMILES： BrC1C=CC2=C(C(=CC(=C2C=1)OC(C)=O)OC(C)=O)OC(C)=O
Computed Properties
- Exact Mass: 379.98949
- Monoisotopic Mass: 379.98955g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 23
- Rotatable Bond Count: 6
- Complexity: 479
- 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: 3.1
- Topological Polar Surface Area: 78.9?2
Experimental Properties
- PSA: 78.9
- LogP: 3.37820
Related Literature
-
Jason Wan Lab Chip, 2020,20, 4528-4538
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
-
David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
-
Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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