AG00245C

18281-04-4 | Nonadecanoic acid, ethyl ester

AG00245C

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CAS Number	18281-04-4
Catalog Number	AG00245C(AGN-PC-0JKKG4)
Chemical Name	Nonadecanoic acid, ethyl ester
IUPAC Name	ethyl nonadecanoate
InChI	InChI=1S/C21H42O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23-4-2/h3-20H2,1-2H3
InChI Key	ICVYQLQYVCXJNE-UHFFFAOYSA-N
MDL Number	MFCD00026690
Molecular Formula	C21H42O2
Molecular Weight	326.5570
NSC Number	136559
SMILES	CCCCCCCCCCCCCCCCCCC(OCC)=O
Synonyms	ETHYL NONADECANOATE, 18281-04-4, NONADECANOIC ACID ETHYL ESTER, n-Nonadecanoic acid ethyl ester, Nonadecanoic acid, ethyl ester, Pendadecanal, Ethyl nonadecanoate #, ACMC-209ejv, AC1L1GJM, Nonadecanoic acid,ethyl ester, QSPL 081, QSPL 087, SCHEMBL2145618, CTK4D8295, DTXSID90171334, ICVYQLQYVCXJNE-UHFFFAOYSA-N, N-NONADECANOICACIDETHYLESTER, ANW-23129, MFCD00026690, NSC136559, ZINC70455619, AKOS015839821, MCULE-8035292791, NSC-136559, CC-33027, DB-044474, TR-008427, FT-0637669, N0459, C-19882, J-011699, Nonadecanoic acid-ethyl ester 10 microg/mL in Methyl-tert-butyl ether, CID29008,

Complexity	238
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	326.318g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	326.565g/mol
Monoisotopic Mass	326.318g/mol
Rotatable Bond Count	19
Topological Polar Surface Area	26.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	9.4

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

Lot Number