AG00BJ40

216087-92-2 | Phenyl(tetrahydro-2H-pyran-4-yl)methanol

AG00BJ40

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CAS Number	216087-92-2
Catalog Number	AG00BJ40(AGN-PC-0QY62K)
Chemical Name	Phenyl(tetrahydro-2H-pyran-4-yl)methanol
IUPAC Name	oxan-4-yl(phenyl)methanol
InChI	InChI=1S/C12H16O2/c13-12(10-4-2-1-3-5-10)11-6-8-14-9-7-11/h1-5,11-13H,6-9H2
InChI Key	DAXAFMSSNPTLPA-UHFFFAOYSA-N
MDL Number	MFCD17243925
Molecular Formula	C12H16O2
Molecular Weight	192.2542
SMILES	OC(C1=CC=CC=C1)C2CCOCC2
Synonyms	phenyl(tetrahydro-2H-pyran-4-yl)Methanol, 216087-92-2, oxan-4-yl(phenyl)methanol, (Oxan-4-yl)(phenyl)methanol, SCHEMBL15995417, DAXAFMSSNPTLPA-UHFFFAOYSA-N, (R)-(Oxan-4-yl)(phenyl)methanol, (S)-(Oxan-4-yl)(phenyl)methanol, MFCD17243925, AKOS012203118, CS-12873, SY232891, 2-Chloro-4-fluoro-5-methoxyphenylboronicacid, CS-0060499, MFCD17243925 (97%), 2H-Pyran-4-methanol, tetrahydro-alpha-phenyl-, racemic phenyl(tetrahydro-2H-pyran-4-yl)methanol, A1-08306, F2167-4289, 1800345-36-1, 910629-24-2, (tetrahydro-2H-pyran-4-yl)(phenyl)methanol,

Complexity	158
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	192.115g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	192.258g/mol
Monoisotopic Mass	192.115g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	29.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	1.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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