AG005M6T

67589-47-3 | Trans-4-ethoxyphenyl 4-butylcyclohexanecarboxylate

AG005M6T

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CAS Number	67589-47-3
Catalog Number	AG005M6T(AGN-PC-0OG7UQ)
Chemical Name	Trans-4-ethoxyphenyl 4-butylcyclohexanecarboxylate
EC Number	266-745-0
IUPAC Name	(4-ethoxyphenyl) 4-butylcyclohexane-1-carboxylate
InChI	InChI=1S/C19H28O3/c1-3-5-6-15-7-9-16(10-8-15)19(20)22-18-13-11-17(12-14-18)21-4-2/h11-16H,3-10H2,1-2H3
InChI Key	JAYBMJPZPJBTQZ-UHFFFAOYSA-N
MDL Number	MFCD01941073
Molecular Formula	C19H28O3
Molecular Weight	304.4238
SMILES	O=C(OC1=CC=C(OCC)C=C1)[C@H]2CC[C@H](CCCC)CC2
Synonyms	67589-47-3, Trans-4-ethoxyphenyl 4-butylcyclohexanecarboxylate, 4-Ethoxyphenyl 4-butylcyclohexanecarboxylate, trans-4-Butylcyclohexanecarboxylic acid, 4-ethoxyphenyl ester, 67679-56-5, 4-Ethoxyphenyl trans-4-butylcyclohexanoate, Cyclohexanecarboxylic acid, 4-butyl-, 4-ethoxyphenyl ester, trans-, MFCD00409324, TRANS-4-ETHOXY-PHENYL 4-BUTYLCYCLOHEXANECARBOXYLATE, EINECS 266-745-0, AC1L2YOE, ChemDiv3_000315, AC1Q61DG, Oprea1_361980, Oprea1_472826, SCHEMBL2604713, SCHEMBL2785540, SCHEMBL10097220, SCHEMBL13433676, CTK2F2620, CTK2F7818, JAYBMJPZPJBTQZ-WKILWMFISA-N, HMS1473O07, KS-00000O3M, ZINC2832251, MFCD01941073, AKOS000511680, AKOS027381044, ZINC263584053, MCULE-2066923308, IDI1_019633, NCGC00176155-01, NCGC00176155-02, AK393980, BAS 00162423, DS-13319, CS-0059657, ST50336571, 4-Ethoxyphenyl 4-n-butylcyclohexanecarboxylate, 4-ethoxyphenyl 4-butylcyclohexane-1-carboxylate, 4-Ethoxyphenyl 4-butylcyclohexanecarboxylate #, 4-Ethoxyphenyl-trans-4-butylcyclohexylcarboxylat, AB01333069-02, (4-ethoxyphenyl) 4-butylcyclohexane-1-carboxylate, 4-Ethoxyphenyl trans-4-butylcyclohexanecarboxylate, SR-01000388956, SR-01000388956-1, BRD-K38748693-001-01-5, 4-Butyl-cyclohexanecarboxylic acid 4-ethoxy-phenyl ester, F0266-0243, 4-Butylcyclohexane-1-carboxylic acid 4-ethoxyphenyl ester, Cyclohexanecarboxylic acid, 4-butyl-, 4-ethoxyphenyl ester, trans-4-Butyl-cyclohexanecarboxylic acid 4-ethoxy-phenyl ester, 4beta-Butyl-1alpha-cyclohexanecarboxylic acid 4-ethoxyphenyl ester, C19H28O3, AR-1G2180, CID105459, 4-ethoxyphenyl-4-butylcyclohexancarboxylat, C19-H28-O3, 4-Ethoxyphenyl trans-4-butylcyclohexane-1-carboxylate, Cyclohexanecarboxylic acid, 4-butyl-, 4-methoxyphenyl ester, trans-, 67589-46-2, 68334-56-5,

Complexity	313
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	304.204g/mol
Formal Charge	0
Heavy Atom Count	22
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	304.43g/mol
Monoisotopic Mass	304.204g/mol
Rotatable Bond Count	8
Topological Polar Surface Area	35.5A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	6

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