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Home > Aldehydes > 849671-57-4
849671-57-4 | spiro[2.5]octane-6-carbaldehyde
CAS No: 849671-57-4 Catalog No: AG01BEJJ MDL No:MFCD24678217
Product Description
Catalog Number:
AG01BEJJ
Chemical Name:
spiro[2.5]octane-6-carbaldehyde
CAS Number:
849671-57-4
Molecular Formula:
C9H14O
Molecular Weight:
138.2069
MDL Number:
MFCD24678217
IUPAC Name:
spiro[2.5]octane-6-carbaldehyde
InChI:
InChI=1S/C9H14O/c10-7-8-1-3-9(4-2-8)5-6-9/h7-8H,1-6H2
InChI Key:
LQPGRYWUUGVTPV-UHFFFAOYSA-N
SMILES:
O=CC1CCC2(CC1)CC2
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.104g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.21g/mol
Monoisotopic Mass:
138.104g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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