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2,5-dioxopyrrolidin-1-yl 4-hydroxy-3,5-dimethylbenzoate

2,5-dioxopyrrolidin-1-yl 4-hydroxy-3,5-dimethylbenzoate

CAS: 158788-56-8

Formula: C13H13NO5

SMILES: CC1=CC(=CC(C)=C1O)C(=O)ON1C(=O)CCC1=O

IUPAC: 2,5-dioxopyrrolidin-1-yl 4-hydroxy-3,5-dimethylbenzoate

InChI: InChI=1S/C13H13NO5/c1-7-5-9(6-8(2)12(7)17)13(18)19-14-10(15)3-4-11(14)16/h5-6,17H,3-4H2,1-2H3

Composition: C (59.31%), H (4.98%), N (5.32%), O (30.39%)

Molar Mass: 263.249

Atom Count: 32

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 263.079372523
Formal Charge 0
FSP3 0.31
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey BDNWJMZEWIQHIP-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 65.93
Topological Polar Surface Area 83.91
Polarizability 25.07
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS UnitPrice
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Purity LeadTime CAS PacketSize UnitPrice
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