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137644-94-1 | 3-BROMO-6-HYDROXY-2-METHYLBENZALDEHYDE
CAS No: 137644-94-1 Catalog No: AG01BOZ1 MDL No:MFCD21607420
Product Description
Catalog Number:
AG01BOZ1
Chemical Name:
3-BROMO-6-HYDROXY-2-METHYLBENZALDEHYDE
CAS Number:
137644-94-1
Molecular Formula:
C8H7BrO2
Molecular Weight:
215.0440
MDL Number:
MFCD21607420
IUPAC Name:
3-bromo-6-hydroxy-2-methylbenzaldehyde
InChI:
InChI=1S/C8H7BrO2/c1-5-6(4-10)8(11)3-2-7(5)9/h2-4,11H,1H3
InChI Key:
GYSFTNVHSLJTCO-UHFFFAOYSA-N
SMILES:
O=Cc1c(O)ccc(c1C)Br
Properties
Complexity:
149
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.963g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
215.046g/mol
Monoisotopic Mass:
213.963g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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