3-(2,5-Dimethyl-1H-pyrrol-1-yl)-4-methylbenzoic acid

Name: 3-(2,5-Dimethyl-1H-pyrrol-1-yl)-4-methylbenzoic acid
Brand: ChemScene
Availability: InStock
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CAS No. 313701-78-9
Cat. No. CS-0327911
Purity≥98%
MDL No.None

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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3-(2,5-Dimethyl-1H-pyrrol-1-yl)-4-methylbenzoic acid|CS-0327911

Structure of 313701-78-9

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General Information

CAS No. 313701-78-9
Cat. No. CS-0327911
Purity ≥98%
MDL No. None
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₄H₁₅NO₂
Molecular Weight 229.27
Synonym(s) UKRORGSYN-BB BBR-020341
SMILES CC1=C(C=C(C=C1)C(=O)O)N2C(=CC=C2C)C

Safety Information

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GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H226
Precautionary Statements : P210-P233-P240-P241-P242-P243-P280-P370+P378-P501

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Computational Chemistry Data

TPSA 42.23
LogP 3.10076
H_Acceptors 2
H_Donors 1
Rotatable_Bonds 2

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Pyrrole compounds

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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3-(2,5-Dimethyl-1H-pyrrol-1-yl)-4-methylbenzoic acid

CAS No. 313701-78-9

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