AG00BXCW

33581-98-5 | Pyrimidin-4-yl-methanol

AG00BXCW

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CAS Number	33581-98-5
Catalog Number	AG00BXCW(AGN-PC-00K5C5)
Chemical Name	Pyrimidin-4-yl-methanol
IUPAC Name	pyrimidin-4-ylmethanol
InChI	InChI=1S/C5H6N2O/c8-3-5-1-2-6-4-7-5/h1-2,4,8H,3H2
InChI Key	OEYVFRVNVPKHQQ-UHFFFAOYSA-N
MDL Number	MFCD03789625
Molecular Formula	C5H6N2O
Molecular Weight	110.1139
SMILES	OCC1=NC=NC=C1
Synonyms	33581-98-5, 4-Pyrimidinemethanol, Pyrimidin-4-ylmethanol, 4-(Hydroxymethyl)pyrimidine, (pyrimidin-4-yl)methanol, Pyrimidin-4-yl-Methanol, MFCD03789625, 4-pyrimidinylmethanol, PubChem9756, Pyrimidine-4-methanol, 4-pyrimidylmethyl alcohol, pyrimidin-4-ylmethan-1-ol, SCHEMBL1821167, 4-(Hydroxymethyl)-1,3-diazine, CTK1C2169, DTXSID80513325, OEYVFRVNVPKHQQ-UHFFFAOYSA-N, ZINC2511466, ANW-51328, BBL100548, CP-541, SBB054828, STL554342, AKOS005254376, PB12296, RP08464, VP50255, AJ-36555, AK-31889, AN-17093, BC228082, BR-31889, SC-03571, TS-01538, AB0024286, AB1011768, DB-013169, ST1141006, TR-014041, 4CH-000678, AM20090513, FT-0678649, W5525, C-8579, P80047, 581P985, A821856, I03-0443, J-019262, J-515991, 4-Pyrimidinemethanol (9CI), C5H6N2O,

Complexity	67.4
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	110.048g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	110.116g/mol
Monoisotopic Mass	110.048g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	46A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number