Cas no 906663-75-0 (Benzene, 1-(heptyloxy)-2-methoxy-)
906663-75-0 structure
Product Name:Benzene, 1-(heptyloxy)-2-methoxy-
CAS No:906663-75-0
MF:C14H22O2
MW:222.323284626007
CID:749735
PubChem ID:71156515
Update Time:2025-04-19
Benzene, 1-(heptyloxy)-2-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1-(heptyloxy)-2-methoxy-
- 1-heptoxy-2-methoxybenzene
- 906663-75-0
- DTXSID20744171
- SCHEMBL14382275
- 1-(HEPTYLOXY)-2-METHOXYBENZENE
-
- Inchi： 1S/C14H22O2/c1-3-4-5-6-9-12-16-14-11-8-7-10-13(14)15-2/h7-8,10-11H,3-6,9,12H2,1-2H3
- InChI Key： ZETRYINZXQAGPD-UHFFFAOYSA-N
- SMILES： O(C1C=CC=CC=1OC)CCCCCCC
Computed Properties
- Exact Mass: 222.161979940g/mol
- Monoisotopic Mass: 222.161979940g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 16
- Rotatable Bond Count: 8
- Complexity: 159
- 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: 4.7
- Topological Polar Surface Area: 18.5?2
Benzene, 1-(heptyloxy)-2-methoxy- 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
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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