AG001TO3

16308-68-2 | Carbonic acid, phenyl 2-propen-1-yl ester

AG001TO3

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CAS Number	16308-68-2
Catalog Number	AG001TO3(AGN-PC-0Q8CTK)
Chemical Name	Carbonic acid, phenyl 2-propen-1-yl ester
IUPAC Name	phenyl prop-2-enyl carbonate
InChI	InChI=1S/C10H10O3/c1-2-8-12-10(11)13-9-6-4-3-5-7-9/h2-7H,1,8H2
InChI Key	ORUWSEKEVGOAQR-UHFFFAOYSA-N
MDL Number	MFCD07784342
Molecular Formula	C10H10O3
Molecular Weight	178.1846
SMILES	O=C(OCC=C)OC1=CC=CC=C1
Synonyms	Allyl phenyl carbonate, 16308-68-2, Carbonic Acid Allyl Phenyl Ester, ORUWSEKEVGOAQR-UHFFFAOYSA-N, ACMC-209dp9, Allyl phenyl carbonate, 97%, SCHEMBL545547, Carbonic acid allylphenyl ester, DTXSID90465028, Carbonic acid, allyl phenyl ester, ANW-22027, MFCD07784342, ZINC25723557, AKOS015840322, PHENYL PROP-2-EN-1-YL CARBONATE, AK656212, AS-10475, AB1011487, TR-006983, J-009998, I14-90936, allyl 2-phenylethylcarbonate, Phenyl Prop-2-enyl Carbonate, CID11412694, A2303,

Complexity	171
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	178.063g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	178.187g/mol
Monoisotopic Mass	178.063g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

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