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113494-78-3 | Propanal, 3-[(phenylmethoxy)methoxy]-
CAS No: 113494-78-3 Catalog No: AG0008RN MDL No:
Product Description
Catalog Number:
AG0008RN
Chemical Name:
Propanal, 3-[(phenylmethoxy)methoxy]-
CAS Number:
113494-78-3
Molecular Formula:
C11H14O3
Molecular Weight:
194.2271
IUPAC Name:
3-(phenylmethoxymethoxy)propanal
InChI:
InChI=1S/C11H14O3/c12-7-4-8-13-10-14-9-11-5-2-1-3-6-11/h1-3,5-7H,4,8-10H2
InChI Key:
AWOVDTUFWGJQGG-UHFFFAOYSA-N
SMILES:
O=CCCOCOCc1ccccc1
Properties
Complexity:
142
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.094g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.23g/mol
Monoisotopic Mass:
194.094g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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