Cas no 102059-70-1 (1,3-Benzenedicarboxylicacid, 5-(benzoyloxy)-)
102059-70-1 structure
Product Name:1,3-Benzenedicarboxylicacid, 5-(benzoyloxy)-
CAS No:102059-70-1
MF:C15H10O6
MW:286.236304759979
CID:124880
PubChem ID:12142462
Update Time:2025-04-18
1,3-Benzenedicarboxylicacid, 5-(benzoyloxy)- Chemical and Physical Properties
Names and Identifiers
-
- 1,3-Benzenedicarboxylicacid, 5-(benzoyloxy)-
- 5-benzoyloxybenzene-1,3-dicarboxylic acid
- BENZOYLOXY-3,5-BENZENEDICARBOXYLICACID
- 102059-70-1
- DTXSID70478454
- 5-(Benzoyloxy)benzene-1,3-dicarboxylic acid
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- Inchi： 1S/C15H10O6/c16-13(17)10-6-11(14(18)19)8-12(7-10)21-15(20)9-4-2-1-3-5-9/h1-8H,(H,16,17)(H,18,19)
- InChI Key： XDZUONXJNHZFMP-UHFFFAOYSA-N
- SMILES： O(C(C1C=CC=CC=1)=O)C1C=C(C(=O)O)C=C(C(=O)O)C=1
Computed Properties
- Exact Mass: 286.04773803g/mol
- Monoisotopic Mass: 286.04773803g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 21
- Rotatable Bond Count: 5
- Complexity: 390
- 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: 2.6
- Topological Polar Surface Area: 101?2
Experimental Properties
- PSA: 100.90000
- LogP: 2.30220
1,3-Benzenedicarboxylicacid, 5-(benzoyloxy)- Related Literature
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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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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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
102059-70-1 (1,3-Benzenedicarboxylicacid, 5-(benzoyloxy)-) Related Products
- 744-45-6(Diphenyl isophthalate)
- 93-44-7(naphthalen-2-yl benzoate)
- 10543-12-1(4-(Acetyloxy)-3-methoxybenzoic Acid)
- 93-99-2(Phenyl benzoate)
- 136-36-7(3-Hydroxyphenyl benzoate)
- 94-01-9(1,3-Dibenzoyloxybenzene)
- 2345-34-8(4-Acetoxybenzoic acid)
- 2150-37-0(Methyl 3,5-dimethoxybenzoate)
- 5368-81-0(Methyl 3-methoxybenzoate)
- 121-98-2(Methyl 4-methoxybenzoate)
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