AG00F070

SDS

COA

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CAS Number	56620-43-0
Catalog Number	AG00F070(AGN-PC-0NLCHS)
Chemical Name	3-Isocyanatoprop-1-yne
IUPAC Name	3-isocyanatoprop-1-yne
InChI	InChI=1S/C4H3NO/c1-2-3-5-4-6/h1H,3H2
InChI Key	SHPPDIBKHYVIKL-UHFFFAOYSA-N
MDL Number	MFCD18269640
Molecular Formula	C4H3NO
Molecular Weight	81.0727
SMILES	O=C=NCC#C
Synonyms	3-Isocyanatoprop-1-yne, 56620-43-0, 1-Propyne, 3-isocyanato-, propargylisocyanat, propargyl isocyanate, CTK1F4220, DTXSID20625173, ALBB-026979, MFCD18269640, ZINC62821978, AKOS012411003, SC-66030, F8881-1538,

Complexity	113
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	81.021g/mol
Formal Charge	0
Heavy Atom Count	6
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	81.074g/mol
Monoisotopic Mass	81.021g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	29.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.3

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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