Home Other Building Blocks 3-methyl-1-(oxolan-2-yl)butan-2-one

3-methyl-1-(oxolan-2-yl)butan-2-one

CAS No.:
1182964-39-1
Catalog Number:
AG01B5JW
Molecular Formula:
C9H16O2
Molecular Weight:
156.2221
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Product Description
Catalog Number:
AG01B5JW
Chemical Name:
3-methyl-1-(oxolan-2-yl)butan-2-one
CAS Number:
1182964-39-1
Molecular Formula:
C9H16O2
Molecular Weight:
156.2221
MDL Number:
MFCD12153330
IUPAC Name:
3-methyl-1-(oxolan-2-yl)butan-2-one
InChI:
InChI=1S/C9H16O2/c1-7(2)9(10)6-8-4-3-5-11-8/h7-8H,3-6H2,1-2H3
InChI Key:
YCMDQIOSDZRHLZ-UHFFFAOYSA-N
SMILES:
O=C(C(C)C)CC1CCCO1
Properties
Complexity:
141  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.115g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.225g/mol
Monoisotopic Mass:
156.115g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties