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Home > Aldehydes > 102684-67-3
102684-67-3 | Benzaldehyde, 2-[(5-bromopentyl)oxy]-
CAS No: 102684-67-3 Catalog No: AG00083Z MDL No:
Product Description
Catalog Number:
AG00083Z
Chemical Name:
Benzaldehyde, 2-[(5-bromopentyl)oxy]-
CAS Number:
102684-67-3
Molecular Formula:
C12H15BrO2
Molecular Weight:
271.1503
IUPAC Name:
2-(5-bromopentoxy)benzaldehyde
InChI:
InChI=1S/C12H15BrO2/c13-8-4-1-5-9-15-12-7-3-2-6-11(12)10-14/h2-3,6-7,10H,1,4-5,8-9H2
InChI Key:
MNYOBCBZESZCBI-UHFFFAOYSA-N
SMILES:
BrCCCCCOc1ccccc1C=O
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.026g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.154g/mol
Monoisotopic Mass:
270.026g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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