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144707-69-7 | Benzaldehyde, 3-(3-bromopropoxy)-
CAS No: 144707-69-7 Catalog No: AG001K1F MDL No:MFCD06656204
Product Description
Catalog Number:
AG001K1F
Chemical Name:
Benzaldehyde, 3-(3-bromopropoxy)-
CAS Number:
144707-69-7
Molecular Formula:
C10H11BrO2
Molecular Weight:
243.0971
MDL Number:
MFCD06656204
IUPAC Name:
3-(3-bromopropoxy)benzaldehyde
InChI:
InChI=1S/C10H11BrO2/c11-5-2-6-13-10-4-1-3-9(7-10)8-12/h1,3-4,7-8H,2,5-6H2
InChI Key:
AQVYBJOWJVFFBA-UHFFFAOYSA-N
SMILES:
BrCCCOc1cccc(c1)C=O
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.994g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.1g/mol
Monoisotopic Mass:
241.994g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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