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84930-13-2 | (3-PHENYLPROPOXY)ACETALDEHYDE
CAS No: 84930-13-2 Catalog No: AG008HRH MDL No:
Product Description
Catalog Number:
AG008HRH
Chemical Name:
(3-PHENYLPROPOXY)ACETALDEHYDE
CAS Number:
84930-13-2
Molecular Formula:
C11H14O2
Molecular Weight:
178.2277
IUPAC Name:
2-(3-phenylpropoxy)acetaldehyde
InChI:
InChI=1S/C11H14O2/c12-8-10-13-9-4-7-11-5-2-1-3-6-11/h1-3,5-6,8H,4,7,9-10H2
InChI Key:
JDTAZEDVMRGLPJ-UHFFFAOYSA-N
SMILES:
O=CCOCCCc1ccccc1
EC Number:
284-593-3
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.099g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.231g/mol
Monoisotopic Mass:
178.099g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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