Methyl 2-amino-5-bromobenzoate

Name: Methyl 2-amino-5-bromobenzoate
Brand: ChemScene
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CAS No. 52727-57-8
Cat. No. CS-W007390
Purity≥96%
MDL No.MFCD00144761

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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Methyl 2-amino-5-bromobenzoate|CS-W007390

Structure of 52727-57-8

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General Information

CAS No. 52727-57-8
Cat. No. CS-W007390
Purity ≥96%
MDL No. MFCD00144761
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₈BrNO₂
Molecular Weight 230.06
Synonym(s) None
SMILES COC(C1=C(N)C=CC(Br)=C1)=O

Description

Molecules of methyl 2-amino-5-bromobenzoate are linked by N-H...O bonds and consists of zigzag chains running along the b-axis direction. The nonlinear optical single crystal of M2A5B grown by Sankaranarayanan-Ramasamy (SR) Unidirectional growth method shows good optical transparency and mechanical stability.Methyl 2-amino-5-bromobenzoate may be used in the synthesis of:methyl 5-bromo-2-(1H-pyrrol-1-yl)benzoatemethyl 5-bromo-2-{[(4-methylphenyl)sulfonyl]amino}-benzoate(2-{[4-bromo-2-(methoxycarbonyl)phenyl]amino}-2-oxoethoxy)acetic acid7-bromo-2,3-dihydropyrrolo[2,1-b]quinazolin-9(1H)-one

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 : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

TPSA 52.32
LogP 1.8179
H_Acceptors 3
H_Donors 1
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Amine

Building Blocks Functional Group Bromide

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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Methyl 2-amino-5-bromobenzoate

CAS No. 52727-57-8

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