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(4Z,8E)-bicyclo[10.1.0]trideca-4,8-diene-13-carboxylic acid

(4Z,8E)-bicyclo[10.1.0]trideca-4,8-diene-13-carboxylic acid

CAS: 329912-79-0

Formula: C14H20O2

SMILES: OC(=O)C1C2CCC=CCCC=C/CCC12

IUPAC: (4Z,8E)-bicyclo[10.1.0]trideca-4,8-diene-13-carboxylic acid

InChI: InChI=1/C14H20O2/c15-14(16)13-11-9-7-5-3-1-2-4-6-8-10-12(11)13/h3-6,11-13H,1-2,7-10H2,(H,15,16)/b5-3-,6-4+

Composition: C (76.33%), H (9.15%), O (14.52%)

Molar Mass: 220.312

Atom Count: 36

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 220.146329884
Formal Charge 0
FSP3 0.64
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey IOZRVTUKBUOZNP-CIIODKQPNA-N
Lipinski's Rule of Five 1
Molar Refractivity 66.38
Topological Polar Surface Area 37.3
Polarizability 25.08
Ring Count 2
Rotatable Bond Count 1

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