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(3R)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid

(3R)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid

CAS: 1260609-71-9

Formula: C10H10O3

SMILES: OC(=O)[C@H]1COC2=C(C1)C=CC=C2

IUPAC: (3R)-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid

InChI: InChI=1S/C10H10O3/c11-10(12)8-5-7-3-1-2-4-9(7)13-6-8/h1-4,8H,5-6H2,(H,11,12)/t8-/m1/s1

Composition: C (67.41%), H (5.66%), O (26.94%)

Molar Mass: 178.187

Atom Count: 23

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 178.062994182
Formal Charge 0
FSP3 0.3
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey UGAGZMGJJFSKQM-MRVPVSSYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 46.52
Topological Polar Surface Area 46.53
Polarizability 18.17
Ring Count 2
Rotatable Bond Count 1

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97% <5 Days 1260609-71-9 $301.38-$501.88$301.38$401.00$501.88
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