Cas no 58167-73-0 (2-Propenoic acid, 2-methyl-, 3-hydroxy-2-naphthalenyl ester)
58167-73-0 structure
Product Name:2-Propenoic acid, 2-methyl-, 3-hydroxy-2-naphthalenyl ester
CAS No:58167-73-0
MF:C14H12O3
MW:228.243284225464
CID:342925
PubChem ID:21243989
Update Time:2025-04-19
2-Propenoic acid, 2-methyl-, 3-hydroxy-2-naphthalenyl ester Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenoic acid, 2-methyl-, 3-hydroxy-2-naphthalenyl ester
- (3-hydroxynaphthalen-2-yl) 2-methylprop-2-enoate
- 58167-73-0
- DTXSID30611582
- 3-Hydroxynaphthalen-2-yl 2-methylprop-2-enoate
- SCHEMBL1801152
-
- Inchi： 1S/C14H12O3/c1-9(2)14(16)17-13-8-11-6-4-3-5-10(11)7-12(13)15/h3-8,15H,1H2,2H3
- InChI Key： AJTXWTPHVAHMRJ-UHFFFAOYSA-N
- SMILES： O(C(C(=C)C)=O)C1=C(C=C2C=CC=CC2=C1)O
Computed Properties
- Exact Mass: 228.07866
- Monoisotopic Mass: 228.078644241g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 311
- 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: 3.5
- Topological Polar Surface Area: 46.5?2
Experimental Properties
- PSA: 46.53
2-Propenoic acid, 2-methyl-, 3-hydroxy-2-naphthalenyl ester Related Literature
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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