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4-(carbamoylmethoxy)-3-methoxybenzoic acid

4-(carbamoylmethoxy)-3-methoxybenzoic acid

Formula: C10H11NO5

SMILES: COC1=C(OCC(N)=O)C=CC(=C1)C(O)=O

IUPAC: 4-(carbamoylmethoxy)-3-methoxybenzoic acid

InChI: InChI=1S/C10H11NO5/c1-15-8-4-6(10(13)14)2-3-7(8)16-5-9(11)12/h2-4H,5H2,1H3,(H2,11,12)(H,13,14)

Composition: C (53.33%), H (4.92%), N (6.22%), O (35.52%)

Molar Mass: 225.2

Atom Count: 27

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 225.063722458
Formal Charge 0
FSP3 0.2
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 2
InChIKey STZBKCNMBXLARH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.15
Topological Polar Surface Area 98.85
Polarizability 20.87
Ring Count 1
Rotatable Bond Count 5

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Purity LeadTime Formula UnitPrice
98% <10 Days C10H11NO5 Quote Only