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1443348-33-1

1443348-33-1 | 2-[(sec-Butyloxy)methyl]-4-fluorobenzaldehyde

CAS No: 1443348-33-1 Catalog No: AG01FAFO MDL No:

Product Description

Catalog Number:
AG01FAFO
Chemical Name:
2-[(sec-Butyloxy)methyl]-4-fluorobenzaldehyde
CAS Number:
1443348-33-1
Molecular Formula:
C12H15FO2
Molecular Weight:
210.2447
IUPAC Name:
2-(butan-2-yloxymethyl)-4-fluorobenzaldehyde
InChI:
InChI=1S/C12H15FO2/c1-3-9(2)15-8-11-6-12(13)5-4-10(11)7-14/h4-7,9H,3,8H2,1-2H3
InChI Key:
IOTKTVXMHHWRIF-UHFFFAOYSA-N
SMILES:
CC(OCc1cc(F)ccc1C=O)CC

Properties

Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.106g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
210.248g/mol
Monoisotopic Mass:
210.106g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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