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131515-42-9 | Methyl 3-acetylbicyclo[1.1.1]pentane-1-carboxylate
CAS No: 131515-42-9 Catalog No: AG01FHAU MDL No:
Product Description
Catalog Number:
AG01FHAU
Chemical Name:
Methyl 3-acetylbicyclo[1.1.1]pentane-1-carboxylate
CAS Number:
131515-42-9
IUPAC Name:
methyl 3-acetylbicyclo[1.1.1]pentane-1-carboxylate
InChI:
InChI=1S/C9H12O3/c1-6(10)8-3-9(4-8,5-8)7(11)12-2/h3-5H2,1-2H3
InChI Key:
ZFHWXHQNMAFOMH-UHFFFAOYSA-N
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.192g/mol
Monoisotopic Mass:
168.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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