AG003DHZ

3634-83-1 | 1,3-Bis(Isocyanatomethyl)Benzene

AG003DHZ

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CAS Number	3634-83-1
Catalog Number	AG003DHZ(AGN-PC-0WA43I)
Chemical Name	1,3-Bis(Isocyanatomethyl)Benzene
EC Number	222-852-4
IUPAC Name	1,3-bis(isocyanatomethyl)benzene
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
MDL Number	MFCD00019917
Molecular Formula	C10H8N2O2
Molecular Weight	188.1827
SMILES	N(=C=O)CC1=CC(=CC=C1)CN=C=O
UNII	D85XJ1813J
Synonyms	1,3-Bis(isocyanatomethyl)benzene, m-Xylylene diisocyanate, 3634-83-1, m-Xylene diisocyanate, Takenate, Takenate 500, Benzene, 1,3-bis(isocyanatomethyl)-, M-Xdi, m-Xylidene diisocyanate, m-Xylylendiisokyanat, m-Phenylenedimethylene isocyanate, m-Xylylendiisokyanat [Czech], UNII-D85XJ1813J, m-xylylenediisocyanate, 1,3-Bis-(isokyanatomethyl)benzen, EINECS 222-852-4, ISOCYANIC ACID, m-PHENYLENEDIMETHYLENE ESTER, BRN 0781825, 1,3-Bis-(isokyanatomethyl)benzen [Czech], RTTZISZSHSCFRH-UHFFFAOYSA-N, D85XJ1813J, Isocyanic Acid 1,3-Phenylenedimethylene Ester, W-106624, 1,3-bis[isocyanatomethyl]benzene, ACMC-1COTW, EC 222-852-4, AC1L2DS5, DSSTox_CID_18919, DSSTox_GSID_38919, SCHEMBL26785, m-Xylylene diisocyanate (XDI), Jsp006477, DTXSID5038919, CTK3J3638, ZINC2038599, Tox21_303869, ANW-28390, MFCD00019917, AKOS000120090, ACM3634331, ACM3634831, MCULE-7005036039, RTR-014902, NCGC00357268-01, BBV-75780606, LS-84459, CAS-3634-83-1, m-xylylene diisocyanate, m-XDI, 1,3-XDI, TR-014902, FT-0629044, m-Xylylene diisocyanate, technical, >=90% (GC), I01-10323, m-Xylylene diisocyanate;Isocyanic acid, m-phenylenedimethylene ester, 3634-33-1, Xylylene diisocyanate, 1,3-Bis benzene, Benzene, bis(isocyanatomethyl)-, CID19262, C10-H8-N2-O2, X0022, 4-13-00-00293 (Beilstein Handbook Reference), m-Xylylene diisocyanate, 98% - 100G 100g, 26471-62-5, 25854-16-4,

Complexity	239
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	188.059g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	188.186g/mol
Monoisotopic Mass	188.059g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	58.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.4

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8(3)
Hazard statements	H226-H314-H334
Packing Group	Ⅱ
Precautionary statements	P210-P261-P280-P284-P303+P361+P353-P304+P340+P310-P305+P351+P338-P342+P311
UN Code	UN 2920

Certificate of Analysis

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