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17837-41-1

17837-41-1 | Thietane, 2-methyl-

CAS No: 17837-41-1 Catalog No: AG0025YY MDL No:

Product Description

Catalog Number:
AG0025YY
Chemical Name:
Thietane, 2-methyl-
CAS Number:
17837-41-1
Molecular Formula:
C4H8S
Molecular Weight:
88.1713
IUPAC Name:
2-methylthietane
InChI:
InChI=1S/C4H8S/c1-4-2-3-5-4/h4H,2-3H2,1H3
InChI Key:
DUTRXPYVMIFJQZ-UHFFFAOYSA-N
SMILES:
CC1CCS1

Properties

Complexity:
34.6  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
88.035g/mol
Formal Charge:
0
Heavy Atom Count:
5  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
88.168g/mol
Monoisotopic Mass:
88.035g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  

Literature

Title Journal
Genetic networks controlling structural outcome of glucosinolate activation across development. PLoS genetics 20081001

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