Cas no 65916-89-4 (1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene)
![1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene structure](https://ossimg.kuujia.com/scimg/66000/65916-89-4x500.png)
65916-89-4 structure
Product Name:1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene
CAS No:65916-89-4
MF:C15H10N2O2
MW:250.252103328705
CID:962813
PubChem ID:7570
Update Time:2025-04-19
1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene Chemical and Physical Properties
Names and Identifiers
-
- 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene
-
- Inchi： 1S/C15H10N2O2/c18-10-16-14-5-1-12(2-6-14)9-13-3-7-15(8-4-13)17-11-19/h1-8H,9H2
- InChI Key： UPMLOUAZCHDJJD-UHFFFAOYSA-N
- SMILES： O=C=NC1C=CC(=CC=1)CC1C=CC(=CC=1)N=C=O
Computed Properties
- Exact Mass: 250.074
- Monoisotopic Mass: 250.074
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 4
- Complexity: 332
- 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
- Topological Polar Surface Area: 58.9A^2
- XLogP3: 5.4
Experimental Properties
- Color/Form: White to yellowish flakes or crystals
- Density: 1.19
- Melting Point: 37oC
- Boiling Point: 196oC at 5 MM HG
- Flash Point: 196℃
- Refractive Index: 1.5906 (50 C)
- PSA: 58.86000
- LogP: 3.21200
1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene Security Information
- Storage Condition：Cold storage
1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene Related Literature
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
65916-89-4 (1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene) Related Products
- 23138-58-1(1-ethyl-3-isocyanatobenzene)
- 2422-91-5(1,1',1''-Methylidynetris4-isocyanato-benzene (25-35% in ethyl acetate))
- 480439-07-4(3-Benzylphenyl Isocyanate)
- 9016-87-9(Polymethylene(polyphenyl Isocyanate) (Mn~340-400))
- 23138-50-3(1-ethyl-4-isocyanatobenzene)
- 1823-37-6(4'-Benzylphenyl Isocyanate)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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