Cas no 64019-77-8 (1,2-Benzenedicarboxylic acid, 3,6-dimethoxy-)
64019-77-8 structure
Product Name:1,2-Benzenedicarboxylic acid, 3,6-dimethoxy-
CAS No:64019-77-8
MF:C10H10O6
MW:226.182803630829
CID:1664744
PubChem ID:3334644
Update Time:2025-04-21
1,2-Benzenedicarboxylic acid, 3,6-dimethoxy- Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Benzenedicarboxylic acid, 3,6-dimethoxy-
- SCHEMBL8996451
- AKOS023398771
- 3,6-Dimethoxybenzene-1,2-dicarboxylic acid
- F2147-5232
- 3,6-dimethoxyphthalic Acid
- 64019-77-8
- VHBUDUULDRSEDI-UHFFFAOYSA-N
-
- Inchi： 1S/C10H10O6/c1-15-5-3-4-6(16-2)8(10(13)14)7(5)9(11)12/h3-4H,1-2H3,(H,11,12)(H,13,14)
- InChI Key： VHBUDUULDRSEDI-UHFFFAOYSA-N
- SMILES： O(C)C1=CC=C(C(C(=O)O)=C1C(=O)O)OC
Computed Properties
- Exact Mass: 226.0477
- Monoisotopic Mass: 226.04773803g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 16
- Rotatable Bond Count: 4
- Complexity: 249
- 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: 0.2
- Topological Polar Surface Area: 93.1?2
Experimental Properties
- PSA: 93.06
1,2-Benzenedicarboxylic acid, 3,6-dimethoxy- Related Literature
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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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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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4. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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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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