AG00DNN8

Name: 1-Isocyanato-3-(propan-2-yl)benzene
Brand: Angene Chemical
SKU: AG00DNN8

55304-09-1 | 1-Isocyanato-3-(propan-2-yl)benzene

AG00DNN8

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CAS Number	55304-09-1
Catalog Number	AG00DNN8(AGN-PC-0033UM)
Chemical Name	1-Isocyanato-3-(propan-2-yl)benzene
IUPAC Name	1-isocyanato-3-propan-2-ylbenzene
InChI	InChI=1S/C10H11NO/c1-8(2)9-4-3-5-10(6-9)11-7-12/h3-6,8H,1-2H3
InChI Key	IVLLJZFRQMSRRX-UHFFFAOYSA-N
MDL Number	MFCD18269663
Molecular Formula	C10H11NO
Molecular Weight	161.2004
SMILES	CC(C1=CC(N=C=O)=CC=C1)C
Synonyms	1-isocyanato-3-(propan-2-yl)benzene, 55304-09-1, BENZENE, 1-ISOCYANATO-3-(1-METHYLETHYL)- (9CI), 3-Isopropylphenyl isocyanate, SCHEMBL11402198, CTK5A3375, DTXSID20566052, ZINC39103788, AKOS012410815, NE23496, BENZENE, 1-ISOCYANATO-3-(1-METHYLETHYL)-, Benzene,1-isocyanato-3- -,

Complexity	182
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	161.084g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	161.204g/mol
Monoisotopic Mass	161.084g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	29.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

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