AG019KHW

Name: 1-Isocyanato-2,3-dimethoxybenzene
Brand: Angene Chemical
SKU: AG019KHW

78645-88-2 | 1-Isocyanato-2,3-dimethoxybenzene

AG019KHW

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CAS Number	78645-88-2
Catalog Number	AG019KHW(AGN-PC-0NJRRM)
Chemical Name	1-Isocyanato-2,3-dimethoxybenzene
IUPAC Name	1-isocyanato-2,3-dimethoxybenzene
InChI	InChI=1S/C9H9NO3/c1-12-8-5-3-4-7(10-6-11)9(8)13-2/h3-5H,1-2H3
InChI Key	CAJBJSNTODHAAU-UHFFFAOYSA-N
MDL Number	MFCD08444550
Molecular Formula	C9H9NO3
Molecular Weight	179.1727
SMILES	COC1=C(OC)C(N=C=O)=CC=C1
Synonyms	1-isocyanato-2,3-dimethoxybenzene, 78645-88-2, AC1Q46EY, SCHEMBL1332133, CTK7G9916, 1-Isocyanato-2,3-dimethoxy-benzene, ZINC12505332, AKOS000202530, Benzene, 1-isocyanato-2,3-dimethoxy-, MCULE-1243389280, NE51344, EN300-27016, 1-isocyanato-2,3-dimethoxybenzene, AldrichCPR, F2160-0014,

Complexity	201
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	179.058g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	179.175g/mol
Monoisotopic Mass	179.058g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	47.9A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited