Text Search
Structure Search

methyl 2-hydroxy-4-methyl-3-nitrobenzoate

methyl 2-hydroxy-4-methyl-3-nitrobenzoate

CAS: 24279-14-9

Formula: C9H9NO5

SMILES: COC(=O)C1=C(O)C(=C(C)C=C1)[N+]([O-])=O

IUPAC: methyl 2-hydroxy-4-methyl-3-nitrobenzoate

InChI: InChI=1S/C9H9NO5/c1-5-3-4-6(9(12)15-2)8(11)7(5)10(13)14/h3-4,11H,1-2H3

Composition: C (51.19%), H (4.30%), N (6.63%), O (37.88%)

Molar Mass: 211.173

Atom Count: 24

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 211.048072394
Formal Charge 0
FSP3 0.22
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey QOZOFWURSWWUCR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 51.43
Topological Polar Surface Area 89.67
Polarizability 19.13
Ring Count 1
Rotatable Bond Count 3

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Chemcia Scientific, LLC
Supplier Profile
Purity LeadTime CAS PacketSize UnitPrice
97% <2 Days 24279-14-9 $241.50-$1,144.25$241.50$339.25$684.25$1,144.25
Request Quote