1-Methylcytosine

CAT: 0931-T10019-01Size: 1 mL - 10 mM (in DMSO)Dry Ice: NoHazardous: No

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CAT#:0931-T10019-01Size:1 mL - 10 mM (in DMSO)

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

1122-47-0

Target

Nucleoside Antimetabolite/Analog

Related Pathways

DNA Damage/DNA Repair, Cell Cycle/Checkpoint

Purity

>99.99%

Bioactivity

1-Methylcytosine (4-amino-1-methylpyrimidin-2 (1H) -one) is a methylated form of the cytosine and can be used as the nucleobase of hachimoji DNA paired with isoguanine.

Smiles

Cn1ccc(N)nc1=O

Molecular Formula

C5H7N3O

Molecular Weight

125.13

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

1-Methylcytosine

1-methylcytosine is a pyrimidone that is cytosine in which the hydrogen attached to the nitrogen at position 1 is substituted by a methyl group. It has a role as a metabolite. It is a methylcytosine, a pyrimidone and an aminopyrimidine. It is functionally related to a cytosine.

CAS Number	1122-47-0
PubChem CID	79143
IUPAC Name	4-amino-1-methylpyrimidin-2-one
Molecular Formula	C5H7N3O
Molecular Weight	125.13
XLogP	-1.1
Topological Polar Surface Area	58.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	9
Formal Charge	0
Complexity	194

SMILES

CN1C=CC(=NC1=O)N

InChI

InChI=1S/C5H7N3O/c1-8-3-2-4(6)7-5(8)9/h2-3H,1H3,(H2,6,7,9)

InChIKey

HWPZZUQOWRWFDB-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1122-47-0

CID: 79143

Formula: C5H7N3O

MW: 125.13

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	125.13
XLogP3	-1.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	125.058911855
Monoisotopic Mass	125.058911855
Topological Polar Surface Area	58.7 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	194
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Alternative Products

Catalog	Name
A9019-25	1-Methylcytosine
HY-W006395R	1-Methylcytosine (Standard)
MBS127569-01	5-Methylcytosine

1-Methylcytosine

Chemical Information

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