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decahydroisoquinoline-3-carboxylic acid

decahydroisoquinoline-3-carboxylic acid

CAS: 82717-30-4

Formula: C10H17NO2

SMILES: OC(=O)C1CC2CCCCC2CN1

IUPAC: decahydroisoquinoline-3-carboxylic acid

InChI: InChI=1/C10H17NO2/c12-10(13)9-5-7-3-1-2-4-8(7)6-11-9/h7-9,11H,1-6H2,(H,12,13)

Composition: C (65.54%), H (9.35%), N (7.64%), O (17.46%)

Molar Mass: 183.251

Atom Count: 30

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 3
Exact Mass 183.125928791
Formal Charge 0
FSP3 0.9
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey NSENYWQRQUNUGD-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 49.09
Topological Polar Surface Area 49.33
Polarizability 19.74
Ring Count 2
Rotatable Bond Count 1

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96% <2 Days 82717-30-4 $134.55-$1,828.50$134.55$157.55$201.25$286.35$457.70$1,828.50
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