AG003FWH

10299-35-1 | 2,5-Diacetoxyhexane

AG003FWH

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CAS Number	10299-35-1
Catalog Number	AG003FWH(AGN-PC-0NVHVC)
Chemical Name	2,5-Diacetoxyhexane
IUPAC Name	5-acetyloxyhexan-2-yl acetate
InChI	InChI=1S/C10H18O4/c1-7(13-9(3)11)5-6-8(2)14-10(4)12/h7-8H,5-6H2,1-4H3
InChI Key	UNAGYNUYXVBAEI-UHFFFAOYSA-N
MDL Number	MFCD09038521
Molecular Formula	C10H18O4
Molecular Weight	202.2475
NSC Number	78970
SMILES	CC(OC(C)=O)CCC(OC(C)=O)C
Synonyms	2,5-Diacetoxyhexane, 10299-35-1, 2,5-Hexanediol Diacetate, hexane-2,5-diyl diacetate, NSC78970, ACMC-1BRF8, AC1L5QH1, NCIOpen2_004456, 5-acetyloxyhexan-2-yl acetate, AC1Q5Y76, 2,5-Hexanediol,2,5-diacetate, SCHEMBL10793944, CTK4A1651, DTXSID80291898, ANW-14784, MFCD09038521, NSC-78970, AKOS025293987, 5-(ACETYLOXY)HEXAN-2-YL ACETATE, TC-103529, D3496, AR-1J1802, CID254550, 10307-28-5,

Complexity	178
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	202.121g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	202.25g/mol
Monoisotopic Mass	202.121g/mol
Rotatable Bond Count	7
Topological Polar Surface Area	52.6A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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