Cas no 59363-22-3 (1,2-Butanediol, 4-(4-methoxyphenyl)-)
59363-22-3 structure
Product Name:1,2-Butanediol, 4-(4-methoxyphenyl)-
CAS No:59363-22-3
MF:C11H16O3
MW:196.242943763733
CID:338956
PubChem ID:12498143
Update Time:2025-04-19
1,2-Butanediol, 4-(4-methoxyphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Butanediol, 4-(4-methoxyphenyl)-
- 4-(4-methoxyphenyl)butane-1,2-diol
- 59363-22-3
- XFVQJJWMYIUTKT-UHFFFAOYSA-N
- DTXSID80500457
- SCHEMBL11451860
- 1-[2-(4-methoxyphenyl)ethyl]-1,2-ethanediol
-
- Inchi： 1S/C11H16O3/c1-14-11-6-3-9(4-7-11)2-5-10(13)8-12/h3-4,6-7,10,12-13H,2,5,8H2,1H3
- InChI Key： XFVQJJWMYIUTKT-UHFFFAOYSA-N
- SMILES： OC(CO)CCC1C=CC(=CC=1)OC
Computed Properties
- Exact Mass: 196.10998
- Monoisotopic Mass: 196.109944368g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 5
- Complexity: 142
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.2
- Topological Polar Surface Area: 49.7?2
Experimental Properties
- PSA: 49.69
1,2-Butanediol, 4-(4-methoxyphenyl)- Related Literature
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H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
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Yuan-Jun Tong,Lu-Dan Yu,Lu-Lu Wu,Shu-Ping Cao,Ru-Ping Liang,Li Zhang,Xing-Hua Xia,Jian-Ding Qiu Chem. Commun., 2018,54, 7487-7490
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
-
Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
59363-22-3 (1,2-Butanediol, 4-(4-methoxyphenyl)-) Related Products
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- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
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