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91335-52-3

91335-52-3 | 3-BROMO-5-METHOXY-4-PROPOXYBENZALDEHYDE

CAS No: 91335-52-3 Catalog No: AG006NS8 MDL No:MFCD02256500

Product Description

Catalog Number:
AG006NS8
Chemical Name:
3-BROMO-5-METHOXY-4-PROPOXYBENZALDEHYDE
CAS Number:
91335-52-3
Molecular Formula:
C11H13BrO3
Molecular Weight:
273.1231
MDL Number:
MFCD02256500
IUPAC Name:
3-bromo-5-methoxy-4-propoxybenzaldehyde
InChI:
InChI=1S/C11H13BrO3/c1-3-4-15-11-9(12)5-8(7-13)6-10(11)14-2/h5-7H,3-4H2,1-2H3
InChI Key:
VLLHMUJXHUSCNF-UHFFFAOYSA-N
SMILES:
CCCOc1c(Br)cc(cc1OC)C=O

Properties

Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.005g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.126g/mol
Monoisotopic Mass:
272.005g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

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