AG0082O5

1123-95-1 | 5-Hydroxymethylcytosine

AG0082O5

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CAS Number	1123-95-1
Catalog Number	AG0082O5(AGN-PC-0NXWMR)
Chemical Name	5-Hydroxymethylcytosine
IUPAC Name	6-amino-5-(hydroxymethyl)-1H-pyrimidin-2-one
InChI	InChI=1S/C5H7N3O2/c6-4-3(2-9)1-7-5(10)8-4/h1,9H,2H2,(H3,6,7,8,10)
InChI Key	RYVNIFSIEDRLSJ-UHFFFAOYSA-N
MDL Number	MFCD00047369
Molecular Formula	C5H7N3O2
Molecular Weight	141.1280
NSC Number	27368
SMILES	O=C1NC=C(CO)C(N)=N1
UNII	6CD2RLN1NK
Synonyms	5-hydroxylmethylcytosine, 5-hydroxymethylcytosine, 5-Hydroxymethylcytosine, 1123-95-1, 4-amino-5-(hydroxymethyl)pyrimidin-2-ol, 4-Amino-5-(hydroxymethyl)-2(1H)-pyrimidinone, 5-HYDROXYMETHYL CYTOSINE, UNII-6CD2RLN1NK, 5-(hydroxymethyl)cytosine, 6-amino-5-(hydroxymethyl)-1H-pyrimidin-2-one, 6CD2RLN1NK, AK-44309, 4-Amino-2-hydroxy-5-hydroxymethylpyrimidine, 4-Amino-5-hydroxymethyl-2(1H)-pyrimidinone, 2(1H)-Pyrimidinone, 4-amino-5-(hydroxymethyl)- (9CI), 5-Oxymethylcytosin, NSC 27368, AC1L2ERY, AC1Q6C9B, SCHEMBL26506, 2(1H)-Pyrimidinone, 4-amino-5-(hydroxymethyl)-, 5-hydroxymethylcytosinefreebase, CHEBI:76792, CTK4A7808, CTK8A3196, DTXSID70149990, ZINC399529, ALBB-023625, KS-00000K1L, NSC27368, ANW-46087, BBL003341, MFCD00047369, NSC-27368, SBB071695, STK803144, AKOS005266249, AKOS006229006, AKOS015854852, 5-(hydroxymethyl)cytosine hydrochloride, CS-W019110, ES-2013, FCH2164265, MCULE-8583103564, AJ-21742, AN-48625, CJ-03746, QC-10213, ST095765, ZB012797, 5-pyrimidinemethanol, 4-amino-2-hydroxy-, AB0093244, AX8002798, DB-007057, ST2412043, TR-002424, 4CH-001478, FT-0084724, FT-0633369, X9007, 4-amino-5-(hydroxymethyl)pyrimidin-2(1H)-one, 2(1H)-Pyrimidinone,6-amino-5-(hydroxymethyl)-, 4-amino-5-(hydroxymethyl)pyrimidin-2-ol ,97%, 123H951, 2-Hydroxy-4-amino-5-(hydroxymethyl)pyrimidine, 95%, 5-hydroxylmethylcytosine, C5H7N3O2, C5-H7-N3-O2, CID70751, RW1604, ACN-053015, A2258, C011865, 2-Hydroxy-4-amino-5-(hydroxymethyl)pyrimidine, 95% - 250MG 250mg, 60638-24-6, HMC,

Complexity	219
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	141.054g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	141.13g/mol
Monoisotopic Mass	141.054g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	87.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.5

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

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