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methyl 2-[1-(sulfanylmethyl)cyclopropyl]acetate

methyl 2-[1-(sulfanylmethyl)cyclopropyl]acetate

CAS: 152922-73-1

Formula: C7H12O2S

SMILES: COC(=O)CC1(CS)CC1

IUPAC: methyl 2-[1-(sulfanylmethyl)cyclopropyl]acetate

InChI: InChI=1S/C7H12O2S/c1-9-6(8)4-7(5-10)2-3-7/h10H,2-5H2,1H3

Composition: C (52.47%), H (7.55%), O (19.97%), S (20.01%)

Molar Mass: 160.23

Atom Count: 22

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 160.0558008
Formal Charge 0
FSP3 0.86
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey JRHLVNAWLWIHDN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 41.67
Topological Polar Surface Area 26.3
Polarizability 16.73
Ring Count 1
Rotatable Bond Count 4

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