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71186-67-9 | 3,4-bis(prop-2-en-1-yloxy)benzaldehyde
CAS No: 71186-67-9 Catalog No: AG005KD2 MDL No:
Product Description
Catalog Number:
AG005KD2
Chemical Name:
3,4-bis(prop-2-en-1-yloxy)benzaldehyde
CAS Number:
71186-67-9
Molecular Formula:
C13H14O3
Molecular Weight:
218.2485
IUPAC Name:
3,4-bis(prop-2-enoxy)benzaldehyde
InChI:
InChI=1S/C13H14O3/c1-3-7-15-12-6-5-11(10-14)9-13(12)16-8-4-2/h3-6,9-10H,1-2,7-8H2
InChI Key:
RMPBVHBECFKPDB-UHFFFAOYSA-N
SMILES:
C=CCOc1cc(C=O)ccc1OCC=C
NSC Number:
138938
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.094g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.252g/mol
Monoisotopic Mass:
218.094g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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