AG01A625

Name: 4-bromo-2-isocyanato-1-methylbenzene
Brand: Angene Chemical
SKU: AG01A625

74738-34-4 | 4-bromo-2-isocyanato-1-methylbenzene

AG01A625

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CAS Number	74738-34-4
Catalog Number	AG01A625
Chemical Name	4-bromo-2-isocyanato-1-methylbenzene
IUPAC Name	4-bromo-2-isocyanato-1-methylbenzene
InChI	InChI=1S/C8H6BrNO/c1-6-2-3-7(9)4-8(6)10-5-11/h2-4H,1H3
InChI Key	VWNWDXOGBBIMGJ-UHFFFAOYSA-N
MDL Number	MFCD18269692
Molecular Formula	C8H6BrNO
Molecular Weight	212.0433
SMILES	CC1=C(N=C=O)C=C(Br)C=C1
Synonyms	4-bromo-2-isocyanato-1-methylbenzene, 74738-34-4, SCHEMBL11233907, 5-bromo-2-methylphenylisocyanate, VWNWDXOGBBIMGJ-UHFFFAOYSA-N, ZINC62822048, AKOS012410934, NE16272, F2163-0157,

Complexity	177
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	210.963g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	212.046g/mol
Monoisotopic Mass	210.963g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	29.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

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