AG00C8O0

Name: methyl 2-isocyanopropanoate
Brand: Angene Chemical
SKU: AG00C8O0

33115-74-1 | methyl 2-isocyanopropanoate

AG00C8O0

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CAS Number	33115-74-1
Catalog Number	AG00C8O0(AGN-PC-0D9IJR)
Chemical Name	methyl 2-isocyanopropanoate
IUPAC Name	methyl 2-isocyanopropanoate
InChI	InChI=1S/C5H7NO2/c1-4(6-2)5(7)8-3/h4H,1,3H3
InChI Key	UFGJMIRODOAASM-UHFFFAOYSA-N
MDL Number	MFCD04117544
Molecular Formula	C5H7NO2
Molecular Weight	113.1146
SMILES	COC(C([N+]#[C-])C)=O
Synonyms	Methyl 2-isocyanopropanoate, 2-Isocyanopropionic acid methyl ester, 33115-74-1, AC1MC1WZ, methyl-2-isocyanopropionate, methyl alpha-isocyanopropionate, Methyl DL-2-isocyanopropionate, SCHEMBL9423011, CTK1B8730, DTXSID90370502, UFGJMIRODOAASM-UHFFFAOYSA-N, Methyl alpha-methylisocyano-acetate, 2-Isocyanopropanoic acid methyl ester, AKOS006292672, METHYL 2-ISOCYANOPROPIONATE, 96, Propanoic acid, 2-isocyano-, methyl ester, CID2734780,

Complexity	133
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	113.048g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	113.116g/mol
Monoisotopic Mass	113.048g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	30.7A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.4

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