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Home > Aldehydes > 2059975-17-4
2059975-17-4 | 2-[1-(methylsulfanyl)cyclobutyl]cyclopropane-1-carbaldehyde
CAS No: 2059975-17-4 Catalog No: AG01BW46 MDL No:MFCD30476761
Product Description
Catalog Number:
AG01BW46
Chemical Name:
2-[1-(methylsulfanyl)cyclobutyl]cyclopropane-1-carbaldehyde
CAS Number:
2059975-17-4
Molecular Formula:
C9H14OS
Molecular Weight:
170.2719
MDL Number:
MFCD30476761
IUPAC Name:
2-(1-methylsulfanylcyclobutyl)cyclopropane-1-carbaldehyde
InChI:
InChI=1S/C9H14OS/c1-11-9(3-2-4-9)8-5-7(8)6-10/h6-8H,2-5H2,1H3
InChI Key:
NXCOICCXZDJQLU-UHFFFAOYSA-N
SMILES:
CSC1(CCC1)C1CC1C=O
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.077g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.27g/mol
Monoisotopic Mass:
170.077g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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