AG00ECXM

6213-88-3 | methyl (E)-3-iodoprop-2-enoate

AG00ECXM

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CAS Number	6213-88-3
Catalog Number	AG00ECXM(AGN-PC-0ODN4I)
Chemical Name	methyl (E)-3-iodoprop-2-enoate
IUPAC Name	methyl (E)-3-iodoprop-2-enoate
InChI	InChI=1S/C4H5IO2/c1-7-4(6)2-3-5/h2-3H,1H3/b3-2+
InChI Key	SUQXOFVGKSUSSM-NSCUHMNNSA-N
MDL Number	MFCD11519163
Molecular Formula	C4H5IO2
Molecular Weight	211.9858
SMILES	O=C(OC)/C=C/I
Synonyms	(E)-methyl 3-iodoacrylate, 6213-88-3, Methyl (E)-3-iodoacrylate, methyl (E)-3-iodoprop-2-enoate, methyl(E)-3-iodoprop-2-enoate, SUQXOFVGKSUSSM-NSCUHMNNSA-N, (E)-3-iodo-acrylic acid methyl ester, J-502608, 3-Iodopropenoic acid methyl ester, trans-Methyl 3-iodo-2-propenoate, AK-49986, AC1NUXVB, PubChem11669, E-2-Propenoic acid, 2-iodo-, methyl ester, C4H5IO2, SCHEMBL4215921, 3-Iodoacrylic acid methyl ester, trans Methyl 3-iodo-2-propenoate, ZINC5996750, 9331AB, MFCD11519163, (E)-3-Iodoacrylic acid methyl ester, FCH1392092, FCH3470212, AJ-55414, DS-15189, AX8137818, DB-038167, TC-162291, A8595, CS-0042162, 2-Propenoic acid, 3-iodo-, methyl ester, (2E)-, methyl -3-iodoprop-2-enoate, (Z)-3-Iodopropenoic acid methyl ester, CID5463376,

Complexity	87.7
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Exact Mass	211.933g/mol
Formal Charge	0
Heavy Atom Count	7
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	211.986g/mol
Monoisotopic Mass	211.933g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

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