6-Bromo-1,2,3,4-tetrahydro-quinoline-2-carboxylic acid methyl ester

C11H12BrNO2CAS 511230-72-1270.13 g/mol

Open in Covalent MOL file
OOHNBr
Aryl halideEsterSecondary amine

Properties

Molecular formula
C11H12BrNO2
Molar mass
270.13 g/mol
Exact mass
269.0051 Da
logP
2.35Crippen estimate
Polar surface area
38.3 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
511230-72-1
SMILES
COC(=O)C1CCC2=C(N1)C=CC(=C2)Br
InChIKey
AUAAQBWEOAMYGG-UHFFFAOYSA-N
InChI
InChI=1S/C11H12BrNO2/c1-15-11(14)10-4-2-7-6-8(12)3-5-9(7)13-10/h3,5-6,10,13H,2,4H2,1H3

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Work with 6-Bromo-1,2,3,4-tetrahydro-quinoline-2-carboxylic acid methyl ester

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Similar compounds

(S)-1,2,3,4-Tetrahydro-quinoline-2-carboxylic acid methyl ester63492-82-065 % similar 6-Bromo-3,4-dihydro-1H-quinolin-2-one3279-90-145 % similar Methyl 4-bromo-2-(bromomethyl)benzoate78471-43-942 % similar 5-Bromoindoline22190-33-641 % similar 6-Bromo-1,4-dihydro-2H-3,1-benzoxazin-2-one1017783-09-341 % similar 5-Bromo-2-oxindole20870-78-440 % similar 6-Bromo-1,2,3,4-tetrahydroquinoline22190-35-840 % similar Methyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate57060-86-340 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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