1745-81-9
1. Introduction of2-Allylphenol
The 2-Allylphenol, with its CAS NO1745-81-9, is a kind ofclear colorless to light yellow liquid. It has syn
1. Introduction of 2-Allylphenol
The 2-Allylphenol, with its CAS NO 1745-81-9, is a kind of clear colorless to light yellow liquid. It has synonyms of Phenol,2-(2-propenyl)- (9CI);Phenol, o-allyl- (6CI,8CI);2-(2-Propenyl)phenol;o-(2-Propenyl)phenol and o-Allylphenol. 2-Allylphenol should be stored in shady and cool warehouse.
2. Properties of 2-Allylphenol
(1) XLogP3 2.7 (2) H-Bond Donor 1 (3) H-Bond Acceptor 1
(4) Rotatable Bond Count 2 (5) Tautomer Count 3 (6) Exact Mass 134.073165
(7) MonoIsotopic Mass 134.073165 (8) Topological Polar Surface Area 20.2
(9) Heavy Atom Count 10 (10) Complexity 109 (11) Covalently-Bonded Unit Count 1
(12) Feature 3D Donor Count 1 (13) Feature 3D Hydrophobe Count 1 (14) Feature 3D Ring Count 1
(15) Effective Rotor Count 2 (16) Conformer Sampling RMSD 0.4 (17) CID Conformer Count 12
3. Structure descriptors of 2-Allylphenol
IUPAC Name: 2-prop-2-enylphenol
InChI: InChI=1S/C9H10O/c1-2-5-8-6-3-4-7-9(8)10/h2-4,6-7,10H,1,5H2
InChIKey: QIRNGVVZBINFMX-UHFFFAOYSA-N
Canonical SMILES : C=CCC1=CC=CC=C1O
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