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Home > Aldehydes > 1432087-58-5
1432087-58-5 | 4-bromo-2,5-dimethyl-1H-pyrrole-3-carbaldehyde
CAS No: 1432087-58-5 Catalog No: AG01DYRM MDL No:MFCD23136113
Product Description
Catalog Number:
AG01DYRM
Chemical Name:
4-bromo-2,5-dimethyl-1H-pyrrole-3-carbaldehyde
CAS Number:
1432087-58-5
Molecular Formula:
C7H8BrNO
Molecular Weight:
202.0485
MDL Number:
MFCD23136113
IUPAC Name:
4-bromo-2,5-dimethyl-1H-pyrrole-3-carbaldehyde
InChI:
InChI=1S/C7H8BrNO/c1-4-6(3-10)7(8)5(2)9-4/h3,9H,1-2H3
InChI Key:
BXEHDSOTEZIZEJ-UHFFFAOYSA-N
SMILES:
O=Cc1c(C)[nH]c(c1Br)C
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.979g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.051g/mol
Monoisotopic Mass:
200.979g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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