1,4,5,6-Tetrahydro-1,2-dimethylpyrimidine

C₆H₁₂N₂CAS 4271-96-9112.18 g/mol

Open in Covalent MOL file

Amidine

Properties

Molecular formula: C₆H₁₂N₂
Molar mass: 112.18 g/mol
Exact mass: 112.1000 Da
Boiling point: 86–90 °C (at 15 Torr)
logP: 0.74Crippen estimate
Polar surface area: 15.6 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Hazards

Danger

H302 Harmful if swallowed100% of notifiers
H311 Toxic in contact with skin34.2% of notifiers
H314 Causes severe skin burns and eye damage99.1% of notifiers
H318 Causes serious eye damage97.3% of notifiers

Aggregated from 111 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P260, P262, P264, P264+P265, P270, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P361+P364, P363, P405, P501

Identifiers

CAS number

4271-96-9

SMILES

CC1=NCCCN1C

InChIKey

ZFDWWDZLRKHULH-UHFFFAOYSA-N

InChI

InChI=1S/C6H12N2/c1-6-7-4-3-5-8(6)2/h3-5H2,1-2H3

Weigh it out

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

Names and synonyms

4 names

Pyrimidine, 1,4,5,6-tetrahydro-1,2-dimethyl-
1,2-Dimethyl-1,4,5,6-tetrahydropyrimidine
2,3-Dimethyl-3,4,5,6-tetrahydropyrimidine
Addocat 1872

Work with 1,4,5,6-Tetrahydro-1,2-dimethylpyrimidine

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

7-Methyl-1,5,7-triazabicyclo[4.4.0]dec-5-ene84030-20-652 % similar 1,5-Diazabicyclo[4.3.0]non-5-ene3001-72-738 % similar DMPU7226-23-536 % similar N-[3-(Dimethylamino)propyl]methacrylamide5205-93-635 % similar Pyrantel15686-83-635 % similar N-Methyl-2-pyrrolidone872-50-434 % similar 1,3-Bis[3-(dimethylamino)propyl]urea52338-87-133 % similar N,N-Dimethylaminopropyl acrylamide3845-76-932 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2-Amino-2,3-dimethylbutanenitrile13893-53-3 1,2-Diazaspiro[2.5]octane185-79-5 Dabco280-57-9 2-(Diethylamino)acetonitrile3010-02-4

Elsewhere

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