Text Search
Structure Search

methyl 4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxylate

methyl 4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxylate

CAS: 166392-24-1

Formula: C8H10N2O2S

SMILES: COC(=O)C1=CN=C(SC)N=C1C

IUPAC: methyl 4-methyl-2-(methylsulfanyl)pyrimidine-5-carboxylate

InChI: InChI=1S/C8H10N2O2S/c1-5-6(7(11)12-2)4-9-8(10-5)13-3/h4H,1-3H3

Composition: C (48.47%), H (5.08%), N (14.13%), O (16.14%), S (16.17%)

Molar Mass: 198.24

Atom Count: 23

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 198.046298744
Formal Charge 0
FSP3 0.37
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey OHLGXWUCKHXDGT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.04
Topological Polar Surface Area 52.08
Polarizability 19.68
Ring Count 1
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 166392-24-1 $49.68-$1,201.64$49.68$82.80$202.86$704.84$1,201.64
Request Quote
AA BLOCKS INC
Supplier Profile
Purity LeadTime CAS PacketSize UnitPrice
95% <6 Days 166392-24-1 $226.55$226.55
Request Quote