AG001W4M

16537-19-2 | tert-Butyl 3-methylbenzoate

AG001W4M

SDS

COA

Price

$0.00

Add to Cart

Buy Now

WARNING This product is not for human or veterinary use.

CAS Number	16537-19-2
Catalog Number	AG001W4M(AGN-PC-0JOCJF)
Chemical Name	tert-Butyl 3-methylbenzoate
IUPAC Name	tert-butyl 3-methylbenzoate
InChI	InChI=1S/C12H16O2/c1-9-6-5-7-10(8-9)11(13)14-12(2,3)4/h5-8H,1-4H3
InChI Key	AWWFAZAXUAVMPE-UHFFFAOYSA-N
MDL Number	MFCD16620897
Molecular Formula	C12H16O2
Molecular Weight	192.2542
NSC Number	38145
SMILES	CC=1C=C(C(=O)OC(C)(C)C)C=CC1
Synonyms	tert-butyl 3-methylbenzoate, 16537-19-2, NSC38145, AC1L5VUK, AC1Q5XKH, SCHEMBL2107215, CTK4D2067, DTXSID80284649, AWWFAZAXUAVMPE-UHFFFAOYSA-N, ZINC1670480, MFCD16620897, NSC-38145, AKOS013211019, 3-Methyl-benzoic acid tert-butyl ester, 3-methylbenzoic acid, [1,1-dimethylethyl] ester, Benzoic acid, 3-methyl-, 1,1-dimethylethyl ester, Benzoicacid, 3-methyl-, 1,1-dimethylethyl ester, AR-1L6032, CID236097, 20133-73-7,

Complexity	203
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	3
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302
Packing Group	\N
Precautionary statements	P264-P270-P301+P312-P330
UN Code	\N

Certificate of Analysis

Lot Number