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24083-06-5 | 3-PENTYLOXY-BENZALDEHYDE
CAS No: 24083-06-5 Catalog No: AG00BCYC MDL No:MFCD01922044
Product Description
Catalog Number:
AG00BCYC
Chemical Name:
3-PENTYLOXY-BENZALDEHYDE
CAS Number:
24083-06-5
Molecular Formula:
C12H16O2
Molecular Weight:
192.2542
MDL Number:
MFCD01922044
IUPAC Name:
3-pentoxybenzaldehyde
InChI:
InChI=1S/C12H16O2/c1-2-3-4-8-14-12-7-5-6-11(9-12)10-13/h5-7,9-10H,2-4,8H2,1H3
InChI Key:
AMTVZBSJJCTNNT-UHFFFAOYSA-N
SMILES:
CCCCCOc1cccc(c1)C=O
Properties
Complexity:
156
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.258g/mol
Monoisotopic Mass:
192.115g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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