2,4-Dichloro-5,6,7,8-tetrahydroquinazoline

C8H8Cl2N2CAS 1127-85-1203.07 g/mol

Open in Covalent MOL file
NNClCl
Aryl halide

Properties

Molecular formula
C8H8Cl2N2
Molar mass
203.07 g/mol
Exact mass
202.0065 Da
logP
2.66Crippen estimate
Polar surface area
25.8 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from the 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, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
1127-85-1
SMILES
C1CCC2=C(C1)C(=NC(=N2)Cl)Cl
InChIKey
KBAXPKVNVXMVKV-UHFFFAOYSA-N
InChI
InChI=1S/C8H8Cl2N2/c9-7-5-3-1-2-4-6(5)11-8(10)12-7/h1-4H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 2,4-Dichloro-5,6,7,8-tetrahydroquinazoline

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,4-Dichloro-6,7-dihydro-5H-cyclopentapyrimidine5466-43-392 % similar 2,4-Dichloro-6,7-dihydrothieno[3,2-D]pyrimidine74901-69-245 % similar 6-Benzyl-2,4-dichloro-5,6,7,8-tetrahydropyrido(4,3-d)pyrimidine778574-06-445 % similar 2,4,5,6-Tetrachloropyrimidine1780-40-141 % similar 2,4,6,8-Tetrachloropyrimido[5,4-d]pyrimidine32980-71-541 % similar tert-Butyl 2,4-dichloro-7,8-dihydropyrido(4,3-d)pyrimidine-6(5H)-carboxylate635698-56-538 % similar tert-Butyl 2,4-dichloro-5,8-dihydropyrido[3,4-d]pyrimidine-7(6H)-carboxylate916420-27-438 % similar 2,4,6-Trichloro-5-methylpyrimidine1780-36-538 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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