Benzoic acid, 4-methyl-3-(1H-pyrrol-1-yl)- (9CI)
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Benzoic acid, 4-methyl-3-(1H-pyrrol-1-yl)- (9CI)
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CAS No:
593272-75-4
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Formula:
C12H11NO2
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Chemical Name:
Benzoic acid, 4-methyl-3-(1H-pyrrol-1-yl)- (9CI)
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Synonyms:
4-methyl-3-(1H-pyrrol-1-yl)benzoic acid;4-Methyl-3-pyrrol-1-yl-benzoic acid;4-methyl-3-pyrrolylbenzoic acid;TimTec1_007649;DTXSID10358226;HMS1555L15;ZINC452862;6356AE;BBL030179;SBB011008
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CAS No:
Benzoic acid, 4-methyl-3-(1H-pyrrol-1-yl)- (9CI) Basic Attributes
201.22124
201.07900
DTXSID10358226
2933990090
Computed Properties
Molecular Weight:201.22
XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:201.078978594
Monoisotopic Mass:201.078978594
Topological Polar Surface Area:42.2
Heavy Atom Count:15
Complexity:236
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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