5-hydroxy-4-(hydroxymethyl)-11-methyl-3,7-dioxa-1,9-diazatricyclo[6.4.0.0²,?]dodeca-8,11-dien-10-one

5-hydroxy-4-(hydroxymethyl)-11-methyl-3,7-dioxa-1,9-diazatricyclo[6.4.0.0²,?]dodeca-8,11-dien-10-one

CAS: 22423-26-3

Formula: C10H12N2O5

SMILES: CC1=CN2C3OC(CO)C(O)C3OC2=NC1=O

IUPAC: 5-hydroxy-4-(hydroxymethyl)-11-methyl-3,7-dioxa-1,9-diazatricyclo[6.4.0.0²,?]dodeca-8,11-dien-10-one

InChI: InChI=1/C10H12N2O5/c1-4-2-12-9-7(6(14)5(3-13)16-9)17-10(12)11-8(4)15/h2,5-7,9,13-14H,3H2,1H3

Composition: C (50.00%), H (5.04%), N (11.66%), O (33.30%)

Molar Mass: 240.215

Atom Count: 29

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	4
Exact Mass	240.074621494
Formal Charge	0
FSP3	0.6
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	2
InChIKey	WLLOAUCNUMYOQI-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.13
Topological Polar Surface Area	91.59
Polarizability	21.5
Ring Count	3
Rotatable Bond Count	1

Suppliers

Molecule Market Select

Purity	LeadTime	CAS		UnitPrice
98%	<14 Days	22423-26-3		Quote Only