Chemical ID: 4280384

CC(=O)OCC1CC1c2ccccc2
Chemical ID:
4280384
Name [?]:
(2-phenylcyclopropyl)methyl acetate
SMILES [?]:
CC(=O)OCC1CC1c2ccccc2
InChi [?]:
InChI=1/C12H14O2/c1-9(13)14-8-11-7-12(11)10-5-3-2-4-6-10/h2-6,11-12H,7-8H2,1H3
InChi Info:
AuxInfo=1/0/N:1,12,11,13,10,14,7,5,2,9,6,8,3,4/E:(3,4)(5,6)/rA:14cCCOOCCCCCCCCCC/rB:s1;d2;s2;s4;s5;s6;s6s7;s8;s9;d10;s11;d12;d9s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H14O2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:2
ZAP Information [?]
Total:7.63104
Area:381.428
Solvation:-1.90467
Coulombic:-19.4709
Bond Count [?]
All:15
Single:11
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:190.238
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.36
LogP (Chemaxon):2.12

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Descriptor Annotations

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