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149428-74-0 | 3-METHOXY-4-(2-PHENYLETHOXY)BENZALDEHYDE
CAS No: 149428-74-0 Catalog No: AG00AK37 MDL No:MFCD03270635
Product Description
Catalog Number:
AG00AK37
Chemical Name:
3-METHOXY-4-(2-PHENYLETHOXY)BENZALDEHYDE
CAS Number:
149428-74-0
Molecular Formula:
C16H16O3
Molecular Weight:
256.2964
MDL Number:
MFCD03270635
IUPAC Name:
3-methoxy-4-(2-phenylethoxy)benzaldehyde
InChI:
InChI=1S/C16H16O3/c1-18-16-11-14(12-17)7-8-15(16)19-10-9-13-5-3-2-4-6-13/h2-8,11-12H,9-10H2,1H3
InChI Key:
LMQXMNKNBDWQMB-UHFFFAOYSA-N
SMILES:
COc1cc(C=O)ccc1OCCc1ccccc1
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.11g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.301g/mol
Monoisotopic Mass:
256.11g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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