5,8-dioxaspiro[3.4]octane-2-carboxylic acid

5,8-dioxaspiro[3.4]octane-2-carboxylic acid

CAS: 1001907-64-7

Formula: C7H10O4

SMILES: OC(=O)C1CC2(C1)OCCO2

IUPAC: 5,8-dioxaspiro[3.4]octane-2-carboxylic acid

InChI: InChI=1S/C7H10O4/c8-6(9)5-3-7(4-5)10-1-2-11-7/h5H,1-4H2,(H,8,9)

Composition: C (53.16%), H (6.37%), O (40.46%)

Molar Mass: 158.153

Atom Count: 21

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	158.057908802
Formal Charge	0
FSP3	0.86
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	PGWGOPXPTJDZKT-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	35.53
Topological Polar Surface Area	55.76
Polarizability	14.22
Ring Count	2
Rotatable Bond Count	1

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