Cas no 183552-86-5 ((9H-fluoren-9-yl)methyl methylcarbamate)
183552-86-5 structure
Product Name:(9H-fluoren-9-yl)methyl methylcarbamate
CAS No:183552-86-5
MF:C16H15NO2
MW:253.295804262161
CID:5704590
PubChem ID:9837923
Update Time:2023-10-15
(9H-fluoren-9-yl)methyl methylcarbamate Chemical and Physical Properties
Names and Identifiers
-
- (9H-fluoren-9-yl)methyl methylcarbamate
- SCHEMBL411680
- 183552-86-5
- 9H-Fluorene-9-methanol, 9-(N-methylcarbamate)
-
- Inchi： 1S/C16H15NO2/c1-17-16(18)19-10-15-13-8-4-2-6-11(13)12-7-3-5-9-14(12)15/h2-9,15H,10H2,1H3,(H,17,18)
- InChI Key： QDNVWQFQXQRDJG-UHFFFAOYSA-N
- SMILES： O(C(NC)=O)CC1C2C=CC=CC=2C2C=CC=CC1=2
Computed Properties
- Exact Mass: 253.110278721g/mol
- Monoisotopic Mass: 253.110278721g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 309
- 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: 38.3?2
Experimental Properties
- Density: 1.179±0.06 g/cm3(Predicted)
- Boiling Point: 432.0±14.0 °C(Predicted)
- pka: 12.41±0.46(Predicted)
(9H-fluoren-9-yl)methyl methylcarbamate Related Literature
-
Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Qiao Song,Angela Bamesberger,Lingyun Yang,Haley Houtwed,Haishi Cao Analyst, 2014,139, 3588-3592
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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