acevaltrate

acevaltrate

CAS: 25161-41-5

Formula: C24H32O10

SMILES: CC(C)CC(=O)OC1OC=C(COC(C)=O)C2=CC(OC(=O)CC(C)(C)OC(C)=O)C3(CO3)C12

IUPAC: 4-[(acetyloxy)methyl]-1-[(3-methylbutanoyl)oxy]-6,7a-dihydro-1H-spiro[cyclopenta[c]pyran-7,2'-oxiran]-6-yl 3-(acetyloxy)-3-methylbutanoate

InChI: InChI=1/C24H32O10/c1-13(2)7-19(27)33-22-21-17(16(11-30-22)10-29-14(3)25)8-18(24(21)12-31-24)32-20(28)9-23(5,6)34-15(4)26/h8,11,13,18,21-22H,7,9-10,12H2,1-6H3

Composition: C (59.99%), H (6.71%), O (33.30%)

Molar Mass: 480.51

Atom Count: 66

Heavy Atom Count: 34

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	4
Exact Mass	480.19954723
Formal Charge	0
FSP3	0.67
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
InChIKey	FWKBQAVMKVZEOT-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	116.09
Topological Polar Surface Area	126.96
Polarizability	46.89
Ring Count	3
Rotatable Bond Count	13

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Molnova Chemicals

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<4 Days	25161-41-5		$68.80-$529.73$68.80$106.25$213.27$337.10$529.73