AG003RIM

272792-14-0 | Methyl 2-(4-cyanophenoxy)acetate

AG003RIM

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CAS Number	272792-14-0
Catalog Number	AG003RIM(AGN-PC-0K664S)
Chemical Name	Methyl 2-(4-cyanophenoxy)acetate
IUPAC Name	methyl 2-(4-cyanophenoxy)acetate
InChI	InChI=1S/C10H9NO3/c1-13-10(12)7-14-9-4-2-8(6-11)3-5-9/h2-5H,7H2,1H3
InChI Key	MAVSETCJUQQWBN-UHFFFAOYSA-N
MDL Number	MFCD05855148
Molecular Formula	C10H9NO3
Molecular Weight	191.1834
SMILES	O=C(OC)COC1=CC=C(C#N)C=C1
Synonyms	methyl (4-cyanophenoxy)acetate, 272792-14-0, methyl 2-(4-cyanophenoxy)acetate, methyl(4-cyanophenoxy)acetate, Acetic acid, (4-cyanophenoxy)-, methyl ester, 2-(4-cyanophenoxy)Acetic acid methyl ester, AC1LTDAV, SCHEMBL2163526, KS-00000BJH, MAVSETCJUQQWBN-UHFFFAOYSA-N, ALBB-024087, ZINC1425998, MFCD05855148, STK735834, AKOS000184950, MCULE-2818641284, TRA0079864, AJ-25834, AK-83723, AS-31760, CJ-04949, SY012813, AB0058901, DB-067757, ST4109136, TC-308347, FT-0744059, K-6954, MFCD05855148 (97+%), Z19234337, A3604/0152744, C10H9NO3, ZINC01425998, CID1506457, 606-20-2,

Complexity	235
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	191.058g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	191.186g/mol
Monoisotopic Mass	191.058g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	59.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number