Cas no 106340-92-5 (1,6-diisocyanato-4,6-dimethylheptane)
106340-92-5 structure
Product Name:1,6-diisocyanato-4,6-dimethylheptane
CAS No:106340-92-5
MF:C11H18N2O2
MW:210.272822856903
CID:1182288
PubChem ID:54137762
Update Time:2025-04-20
1,6-diisocyanato-4,6-dimethylheptane Chemical and Physical Properties
Names and Identifiers
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- 1,6-diisocyanato-4,6-dimethylheptane
- DTXSID50709273
- 106340-92-5
- SCHEMBL3266895
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- Inchi： 1S/C11H18N2O2/c1-10(5-4-6-12-8-14)7-11(2,3)13-9-15/h10H,4-7H2,1-3H3
- InChI Key： NYXJFSYUHVINIA-UHFFFAOYSA-N
- SMILES： O=C=NC(C)(C)CC(C)CCCN=C=O
Computed Properties
- Exact Mass: 210.136827821g/mol
- Monoisotopic Mass: 210.136827821g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 7
- Complexity: 274
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.2
- Topological Polar Surface Area: 58.9?2
1,6-diisocyanato-4,6-dimethylheptane Related Literature
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1. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
106340-92-5 (1,6-diisocyanato-4,6-dimethylheptane) Related Products
- 32175-00-1(trans-4-Methycyclohexyl Isocyanate)
- 38258-74-1(1-isocyanato-4-methylcyclohexane)
- 4411-25-0(1-isocyanatoadamantane)
- 1611-57-0(tert-Octyl Isocyanate)
- 28679-16-5(Trimethylhexamethylene Diisocyanate(2,2,4-and2,4,4-mixture))
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
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