AG002V7L

2901-13-5 | Ethyl 2-methyl-2-phenylpropanoate

AG002V7L

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CAS Number	2901-13-5
Catalog Number	AG002V7L(AGN-PC-0R4RCH)
Chemical Name	Ethyl 2-methyl-2-phenylpropanoate
EC Number	608-307-7
IUPAC Name	ethyl 2-methyl-2-phenylpropanoate
InChI	InChI=1S/C12H16O2/c1-4-14-11(13)12(2,3)10-8-6-5-7-9-10/h5-9H,4H2,1-3H3
InChI Key	OFYSAFPKXXTYLU-UHFFFAOYSA-N
MDL Number	MFCD03844687
Molecular Formula	C12H16O2
Molecular Weight	192.2542
NSC Number	29060
SMILES	CCOC(=O)C(C)(C)C1=CC=CC=C1
Synonyms	ethyl 2-methyl-2-phenylpropanoate, 2901-13-5, Ethyl 2,2-dimethylphenylacetate, 2-methyl-2-phenyl-propionic acid ethyl ester, NSC29060, phenyl ethyl isobutyrate, Ethyl 2-phenylisobutyrate, Ethyl Dimethylphenylacetate, EC 608-307-7, AC1L5N0B, AC1Q63WP, alpha,alpha-Dimethyl-ethyl ester benzeneacetic acid, SCHEMBL395978, CTK4G2565, KS-00000BBO, DTXSID90282994, Ethyl2-Methyl-2-phenylpropanoate, OFYSAFPKXXTYLU-UHFFFAOYSA-N, Ethyl |A,|A-Dimethylphenylacetate, Ethyl 2-methyl-2-phenylpropionate, Ethyl 2-phenyl-2-methylpropionate, Ethyl |A,|A-Dimethylbenzeneacetate, 2-Phenylisobutyric acid ethyl ester, ethyl 2-methyl-2-phenyl-propanoate, ZINC1651925, ANW-63648, MFCD03844687, NSC 29060, NSC-29060, SBB053782, AKOS009166296, ethyl alpha,alpha-dimethylphenylacetate, AC-1049, ACN-050874, MCULE-6149346399, QC-3160, TRA-0189394, AJ-28809, AK-78773, AN-15280, BC208889, CJ-05964, CJ-26725, SY002718, TS-00264, a,a-Dimethyl-benzeneacetic Acid Ethyl Ester, AB0055768, TC-152393, AM20040107, CS-0042637, FT-0080036, FT-0602717, ST24046875, ST50949706, MFCD03844687 (96%), 2-methyl-2-phenyl- propionic acid ethyl ester, K-7129, 901E135, Benzeneacetic acid, |A,|A-dimethyl-, ethyl ester, Benzeneacetic acid, alpha,alpha-dimethyl-, ethyl ester, Ethyl Dimethylbenzeneacetate, C12H16O2, AR-1I8507, CID232036, |A-methyl-hydratropic Acid Ethyl Ester, |A,|A-Dimethyl-benzeneacetic Acid Ethyl Ester, 34553-66-7,

Complexity	191
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	192.115g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	192.258g/mol
Monoisotopic Mass	192.115g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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