Cas no 497242-89-4 (Benzene, 4-fluoro-2-methoxy-1-(2-propynyloxy)-)
497242-89-4 structure
Product Name:Benzene, 4-fluoro-2-methoxy-1-(2-propynyloxy)-
CAS No:497242-89-4
MF:C10H9FO2
MW:180.175666570663
CID:1541457
PubChem ID:5097019
Update Time:2025-04-21
Benzene, 4-fluoro-2-methoxy-1-(2-propynyloxy)- Chemical and Physical Properties
Names and Identifiers
-
- 4-fluoro-2-methoxy-1-prop-2-ynoxybenzene
- Benzene, 4-fluoro-2-methoxy-1-(2-propynyloxy)-
- 4-fluoro-2-methoxy-(prop-2-ynyloxy)-benzene
- DGCNNTWVFCIVMP-UHFFFAOYSA-N
- 497242-89-4
- DTXSID00408269
- SCHEMBL6598860
- 4-fluoro-2-methoxy-1-prop-2-ynyloxy-benzene
- AKOS006237859
-
- Inchi： 1S/C10H9FO2/c1-3-6-13-9-5-4-8(11)7-10(9)12-2/h1,4-5,7H,6H2,2H3
- InChI Key： DGCNNTWVFCIVMP-UHFFFAOYSA-N
- SMILES： FC1C=CC(=C(C=1)OC)OCC#C
Computed Properties
- Exact Mass: 180.05867
- Monoisotopic Mass: 180.05865769g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 196
- 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: 2.1
- Topological Polar Surface Area: 18.5?2
Experimental Properties
- PSA: 18.46
Benzene, 4-fluoro-2-methoxy-1-(2-propynyloxy)- Related Literature
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
-
Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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