2-Amino-5-methyl-4-pyrimidinol - CAS 15981-91-6

Name: 2-Amino-5-methyl-4-pyrimidinol
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB076881
Product Name:	2-Amino-5-methyl-4-pyrimidinol
CAS:	15981-91-6
Synonyms:	5-Methylisocytosine; 2-Amino-5-methylpyrimidin-4(3H)-one; 2-Amino-5-methylpyrimidin-4-ol; 4(1H)-Pyrimidinone, 2-amino-5-methyl-; NSC-60208; 2-Amino-5-methyl-4(3H)-pyrimidinone; 2-Amino-5-methylpyrimidin-4-one

Technical Data

Safety and Hazards

Computed Properties

IUPAC Name:	2-amino-5-methyl-1H-pyrimidin-6-one
Molecular Weight:	125.13
Molecular Formula:	C5H7N3O
Canonical SMILES:	CC1=CN=C(NC1=O)N
InChI:	InChI=1S/C5H7N3O/c1-3-2-7-5(6)8-4(3)9/h2H,1H3,(H3,6,7,8,9)
InChI Key:	YKUFMYSNUQLIQS-UHFFFAOYSA-N
Melting Point:	277-279°C
Purity:	≥95%
Density:	1.44±0.1 g/cm3 (Predicted)
Appearance:	Solid

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Related Functional Groups

Amines and Anilines

[1232060-85-3]C6H13NO2
(3R,4R)-4-Amino-3-methoxytetrahydropyran
[1082066-00-9]C7H8N2O
1-Cyclopropyl-1H-pyrazole-4-carbaldehyde
[17583-40-3]C8H8N2
2-(Methylamino)benzonitrile
[42150-24-3]C5H9N3
2-(4-Pyrazolyl)ethylamine
[438616-66-1]C14H20N2O
2-(4-Tert-Butylphenyl)cyclopropanecarbohydrazide
[1239647-61-0]C7H8N4
2-Amino-6-methyl-[1,2,4]triazolo[1,5-a]pyridine

Other Pyrimidines

[1183749-69-0]C10H8N2O2
2-(pyrimidin-2-yloxy)phenol
[937601-34-8]C9H8BrN3O2
3-Bromo-2,5-dimethylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid
[150517-77-4]C8H7F4N
3-Fluoro-5-(trifluoromethyl)benzylamine
[1632145-37-9]0
3-Methyl-3-(perfluoropyridin-4-yl)-1,5-dioxaspiro[5.5]undecane-2,4-dione
[451-46-7]C9H9FO2
Ethyl 4-fluorobenzoate
[551-62-2]C6H2F4
1,2,3,4-Tetrafluorobenzene

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H318 (100%): Causes serious eye damage [Danger Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	204
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	125.058911855
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	125.058911855
Rotatable Bond Count:	0
Topological Polar Surface Area:	67.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.9