Methyl 3-(3-formyl-2,5-dimethyl-1h-pyrrol-1-yl)-2-methylbenzoate

Name: Methyl 3-(3-formyl-2,5-dimethyl-1h-pyrrol-1-yl)-2-methylbenzoate
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CAS No. 429624-46-4
Cat. No. CS-0117506
Purity≥97%
MDL No.None

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Methyl 3-(3-formyl-2,5-dimethyl-1h-pyrrol-1-yl)-2-methylbenzoate|CS-0117506

Structure of 429624-46-4

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General Information

CAS No. 429624-46-4
Cat. No. CS-0117506
Purity ≥97%
MDL No. None
Storage Sealed in dry,2-8℃
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₆H₁₇NO₃
Molecular Weight 271.31
Synonym(s) Benzoic acid, 3-(3-formyl-2,5-dimethyl-1H-pyrrol-1-yl)-2-methyl-, methyl ester
SMILES O=C(OC)C1=CC=CC(N2C(C)=C(C=O)C=C2C)=C1C

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 48.3
LogP 3.00166
H_Acceptors 4
H_Donors 0
Rotatable_Bonds 3

Other Classifications

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic heterocycle compounds Pyrrole compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

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Methyl 3-(3-formyl-2,5-dimethyl-1h-pyrrol-1-yl)-2-methylbenzoate

CAS No. 429624-46-4

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