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88578-95-4 | Cyclohexaneacetaldehyde, 1-(aminomethyl)-
CAS No: 88578-95-4 Catalog No: AG004BRF MDL No:
Product Description
Catalog Number:
AG004BRF
Chemical Name:
Cyclohexaneacetaldehyde, 1-(aminomethyl)-
CAS Number:
88578-95-4
Molecular Formula:
C9H17NO
Molecular Weight:
155.2374
IUPAC Name:
2-[1-(aminomethyl)cyclohexyl]acetaldehyde
InChI:
InChI=1S/C9H17NO/c10-8-9(6-7-11)4-2-1-3-5-9/h7H,1-6,8,10H2
InChI Key:
GCWCBYLAENXNMJ-UHFFFAOYSA-N
SMILES:
O=CCC1(CN)CCCCC1
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.131g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
155.241g/mol
Monoisotopic Mass:
155.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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