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Home > Aldehydes > 1785187-92-9
1785187-92-9 | 1-phenylpyrrolidine-3-carbaldehyde
CAS No: 1785187-92-9 Catalog No: AG01B3XY MDL No:MFCD22398161
Product Description
Catalog Number:
AG01B3XY
Chemical Name:
1-phenylpyrrolidine-3-carbaldehyde
CAS Number:
1785187-92-9
Molecular Formula:
C11H13NO
Molecular Weight:
175.2270
MDL Number:
MFCD22398161
IUPAC Name:
1-phenylpyrrolidine-3-carbaldehyde
InChI:
InChI=1S/C11H13NO/c13-9-10-6-7-12(8-10)11-4-2-1-3-5-11/h1-5,9-10H,6-8H2
InChI Key:
TYHMTEXVWMSVFT-UHFFFAOYSA-N
SMILES:
O=CC1CCN(C1)c1ccccc1
Properties
Complexity:
175
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.1g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
175.231g/mol
Monoisotopic Mass:
175.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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