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409353-44-2 | 4-(3-Formyl-2
CAS No: 409353-44-2 Catalog No: AG01FO5X MDL No:
Product Description
Catalog Number:
AG01FO5X
Chemical Name:
4-(3-Formyl-2
CAS Number:
409353-44-2
IUPAC Name:
4-(3-formyl-2,5-dimethylpyrrol-1-yl)-3-methylbenzoic acid
InChI:
InChI=1S/C15H15NO3/c1-9-6-12(15(18)19)4-5-14(9)16-10(2)7-13(8-17)11(16)3/h4-8H,1-3H3,(H,18,19)
InChI Key:
GUIKDEPKXYMZGF-UHFFFAOYSA-N
Properties
Complexity:
357
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.105g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
257.289g/mol
Monoisotopic Mass:
257.105g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
59.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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