Home Other Building Blocks tert-butyl 2-(cyclopropylsulfanyl)acetate

tert-butyl 2-(cyclopropylsulfanyl)acetate

CAS No.:
1820608-17-0
Catalog Number:
AG01AMVL
Molecular Formula:
C9H16O2S
Molecular Weight:
188.2871
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Product Description
Catalog Number:
AG01AMVL
Chemical Name:
tert-butyl 2-(cyclopropylsulfanyl)acetate
CAS Number:
1820608-17-0
Molecular Formula:
C9H16O2S
Molecular Weight:
188.2871
MDL Number:
MFCD29034037
IUPAC Name:
tert-butyl 2-cyclopropylsulfanylacetate
InChI:
InChI=1S/C9H16O2S/c1-9(2,3)11-8(10)6-12-7-4-5-7/h7H,4-6H2,1-3H3
InChI Key:
ZPNQFKHRZUXPCU-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)CSC1CC1
Properties
Complexity:
168  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.087g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.285g/mol
Monoisotopic Mass:
188.087g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
51.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties