4-(cyclopropylmethyl)-1??-thiomorpholine-1,1-dione

4-(cyclopropylmethyl)-1??-thiomorpholine-1,1-dione

CAS: 477858-20-1

Formula: C8H15NO2S

SMILES: O=S1(=O)CCN(CC2CC2)CC1

IUPAC: 4-(cyclopropylmethyl)-1??-thiomorpholine-1,1-dione

InChI: InChI=1S/C8H15NO2S/c10-12(11)5-3-9(4-6-12)7-8-1-2-8/h8H,1-7H2

Composition: C (50.77%), H (7.99%), N (7.40%), O (16.91%), S (16.94%)

Molar Mass: 189.27

Atom Count: 27

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	189.082349901
Formal Charge	0
FSP3	1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	NWEGBHIHWJAJLB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.53
Topological Polar Surface Area	37.38
Polarizability	19.73
Ring Count	2
Rotatable Bond Count	2

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