(1S)-2,2-dimethylcyclopropane-1-carboxylic acid

(1S)-2,2-dimethylcyclopropane-1-carboxylic acid

CAS: 14590-53-5

Formula: C6H10O2

SMILES: CC1(C)C[C@@H]1C(O)=O

IUPAC: (1S)-2,2-dimethylcyclopropane-1-carboxylic acid

InChI: InChI=1S/C6H10O2/c1-6(2)3-4(6)5(7)8/h4H,3H2,1-2H3,(H,7,8)/t4-/m1/s1

Composition: C (63.14%), H (8.83%), O (28.03%)

Molar Mass: 114.144

Atom Count: 18

Heavy Atom Count: 8

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	114.068079562
Formal Charge	0
FSP3	0.83
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	BFNMOMYTTGHNGJ-SCSAIBSYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	29.07
Topological Polar Surface Area	37.3
Polarizability	11.59
Ring Count	1
Rotatable Bond Count	1

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