Cas no 28110-65-8 (Benzoic acid,2-hydroxy-,polymers,polymer with 4-(1,1-dimethylethyl)phenol and formaldehyde)
28110-65-8 structure
Product Name:Benzoic acid,2-hydroxy-,polymers,polymer with 4-(1,1-dimethylethyl)phenol and formaldehyde
CAS No:28110-65-8
MF:C18H22O5
MW:318.364285945892
CID:263100
PubChem ID:168758
Update Time:2025-04-19
Benzoic acid,2-hydroxy-,polymers,polymer with 4-(1,1-dimethylethyl)phenol and formaldehyde Chemical and Physical Properties
Names and Identifiers
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- Benzoic acid,2-hydroxy-,polymers,polymer with 4-(1,1-dimethylethyl)phenol and formaldehyde
- 28110-65-8
-
- Inchi: 1S/C10H14O.C7H6O3.CH2O/c1-10(2,3)8-4-6-9(11)7-5-8;8-6-4-2-1-3-5(6)7(9)10;1-2/h4-7,11H,1-3H3;1-4,8H,(H,9,10);1H2
- InChI Key: MVWQDNJZYFHWED-UHFFFAOYSA-N
- SMILES: OC1C=CC(=CC=1)C(C)(C)C.OC1C=CC=CC=1C(=O)O.O=C
Computed Properties
- Exact Mass: 318.147
- Monoisotopic Mass: 318.147
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 23
- Rotatable Bond Count: 2
- Complexity: 250
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 94.8?2
Experimental Properties
- Boiling Point: 233.7°Cat760mmHg
- Flash Point: 110.9°C
Benzoic acid,2-hydroxy-,polymers,polymer with 4-(1,1-dimethylethyl)phenol and formaldehyde Related Literature
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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