AG0037GS

26896-20-8 | Neo-decanoic acid

AG0037GS

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CAS Number	26896-20-8
Catalog Number	AG0037GS(AGN-PC-0WAEJZ)
Chemical Name	Neo-decanoic acid
IUPAC Name	7,7-dimethyloctanoic acid
InChI	InChI=1S/C10H20O2/c1-10(2,3)8-6-4-5-7-9(11)12/h4-8H2,1-3H3,(H,11,12)
InChI Key	YPIFGDQKSSMYHQ-UHFFFAOYSA-N
MDL Number	MFCD16855768
Molecular Formula	C10H20O2
Molecular Weight	172.2646
SMILES	CC(C)(C)CCCCCC(O)=O
Synonyms	neodecanoic acid, Topper 5-E, NEODECANOIC ACID, 26896-20-8, 7,7-dimethyloctanoic acid, NEO-DECANOIC ACID, AK116933, 130776-67-9, Rare earth neodecanoate, Neodecanoic acid, rare earth salts, EINECS 270-175-8, AC1L1XVV, AC1Q1MIJ, SCHEMBL23925, 68412-21-5, neo-decanoic acid, AldrichCPR, neo-Decanoic acid, prime grade, Jsp005255, CTK1A3435, KS-00000GSE, YPIFGDQKSSMYHQ-UHFFFAOYSA-N, ZINC1849686, MFCD00068291, AKOS006345516, CS-W022922, RP23468, AJ-32018, AS-17386, U878, AX8144114, FT-0654977, ST24048788, K-6895, A818664, Topper 5E, Wiltz 65, Caswell No. 365A, NEA (CHRIS Code), UNII-GI044Q7IJ4, 2,2,3,5-Tetramethylhexanoic acid, 2-ethyl-2,5-dimethylhexanoic acid, 2,5-Dimethyl-2-ethylhexanoic acid, C10H20O2, CID62838, EINECS 248-093-9, C10-H20-O2, EPA Pesticide Chemical Code 097501, 2,4-Dimethyl-2-isopropylpentanoic acid, EC 248-093-9, Neodecanoic acid, 98%, mixture of isomers - 100G 100g, NDA,

Complexity	133
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	172.146g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	172.268g/mol
Monoisotopic Mass	172.146g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	37.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H303+H313-H412
Precuationary statements	P273-P501
Siginal words

Certificate of Analysis

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