Cas no 102831-36-7 (Benzenehexanol, 4-methoxy-)
Benzenehexanol, 4-methoxy- structure
Product Name:Benzenehexanol, 4-methoxy-
CAS No:102831-36-7
MF:C13H20O2
MW:208.296704292297
CID:1136542
PubChem ID:14739742
Update Time:2025-04-20
Benzenehexanol, 4-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- Benzenehexanol, 4-methoxy-
- 6-(4-methoxyphenyl)hexan-1-ol
- DTXSID40563467
- SCHEMBL8413383
- 102831-36-7
-
- Inchi： 1S/C13H20O2/c1-15-13-9-7-12(8-10-13)6-4-2-3-5-11-14/h7-10,14H,2-6,11H2,1H3
- InChI Key： YGMHHBMWTJUUIM-UHFFFAOYSA-N
- SMILES： OCCCCCCC1C=CC(=CC=1)OC
Computed Properties
- Exact Mass: 313.20431
- Monoisotopic Mass: 208.146329876g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 7
- Complexity: 140
- 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: 3.3
- Topological Polar Surface Area: 29.5?2
Experimental Properties
- PSA: 41.49
Benzenehexanol, 4-methoxy- Related Literature
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
-
Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
-
M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
-
Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
-
Lei Yang,Yuan Zeng,Haibo Wu,Chunwu Zhou,Lei Tao J. Mater. Chem. B, 2020,8, 1383-1388
102831-36-7 (Benzenehexanol, 4-methoxy-) Related Products
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- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
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- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
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