Cas no 1238700-00-9 (4-Cyclopropylmethyloxy-2-methoxybenzoic acid)
1238700-00-9 structure
Product Name:4-Cyclopropylmethyloxy-2-methoxybenzoic acid
CAS No:1238700-00-9
MF:C12H14O4
MW:222.237164020538
CID:2114003
Update Time:2023-08-04
4-Cyclopropylmethyloxy-2-methoxybenzoic acid Chemical and Physical Properties
Names and Identifiers
-
- 4-(cyclopropylmethoxy)-2-methoxyBenzoic acid
- SFAVBXYGUGSUFQ-UHFFFAOYSA-N
- 4-cyclopropylmethyloxy-2-methoxybenzoic acid
- Benzoic acid, 4-(cyclopropylmethoxy)-2-methoxy-
- 4-Cyclopropylmethyloxy-2-methoxybenzoic acid
-
- Inchi： 1S/C12H14O4/c1-15-11-6-9(16-7-8-2-3-8)4-5-10(11)12(13)14/h4-6,8H,2-3,7H2,1H3,(H,13,14)
- InChI Key： SFAVBXYGUGSUFQ-UHFFFAOYSA-N
- SMILES： O(C1C=CC(C(=O)O)=C(C=1)OC)CC1CC1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 5
- Complexity: 249
- XLogP3: 2
- Topological Polar Surface Area: 55.8
4-Cyclopropylmethyloxy-2-methoxybenzoic acid Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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