m-Xylylene diisocyanate
Product Information
Molecular Formula
C10H8N2O2
Molecular Weight
188.18
Description
m-Xylylene diisocyanate (CAS# 3634-83-1) is a useful research chemical.
Synonyms
1,3-bis(isocyanatomethyl)benzene
IUPAC Name
1,3-bis(isocyanatomethyl)benzene
SMILES
C1=CC(=CC(=C1)CN=C=O)CN=C=O
InChI
InChI=1S/C10H8N2O2/c13-7-11-5-9-2-1-3-10(4-9)6-12-8-14/h1-4H,5-6H2
InChI Key
RTTZISZSHSCFRH-UHFFFAOYSA-N
Boiling Point
88-90 °C / 0.02 mmHg
Melting Point
-7 °C
Flash Point
42 °C (C.C)
Purity
> 98.0 % (GC)
Density
1.202 g/cm3
Appearance
Colorless to light yellow clear liquid
Storage
0-10 °C
Refractive Index
1.5410-1.5450
LogP
1.35820
Safety Information
Hazards
H226 H314 H334
Precautionary Statement
P210, P233, P240, P241, P242, P243, P260, P261, P264, P270, P271, P272, P280, P284, P285, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P304+P341, P305+P351+P338, P307+P311, P310, P311, P312, P314, P320, P321, P332+P313, P333+P313, P337+P313, P342+P311, P362, P363, P370+P378, P403+P233, P403+P235, P405, and P501
Signal Word
Danger
Computed Properties
XLogP3
3.4
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
4
Exact Mass
188.058577502 g/mol
Monoisotopic Mass
188.058577502 g/mol
Topological Polar Surface Area
58.9Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
239
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| JP-2022040328-A | Adhesive composition, adhesive film, surface protective film and optical film with adhesive layer | 2022-01-19 |
| JP-2022033257-A | Adhesive composition, adhesive film and surface protective film | 2022-01-04 |
| CN-114163816-A | Wear-resistant reinforced PPS composition and preparation method and application thereof | 2021-12-31 |
| JP-2022036177-A | Polyester film and gas barrier laminated film | 2021-12-28 |
| JP-2022033203-A | Surface protection film | 2021-12-21 |
| JP-2022033204-A | Surface protection film | 2021-12-21 |
| JP-2022040149-A | Adhesive composition and laminated film using it | 2021-12-21 |
| CN-114031742-A | Biodegradable melt-spun spandex slice and preparation method and application thereof | 2021-12-15 |
| CN-113999336-A | Star cis-1, 4-polyisoprene with high green strength and preparation method thereof | 2021-12-08 |
| JP-2022022342-A | Surface protection film | 2021-12-07 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 17566329 | 2007-05-01 | Preparation and chiral recognition ability of crosslinked beads of polysaccharide derivatives | Journal of separation science |
