2-Methoxy-2-phenylethanol

CAT: 0926-FM154645-02Size: 5 gDry Ice: NoHazardous: No

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CAT#:0926-FM154645-02Size:5 g

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CAS Number

2979-22-8

Smiles

COC (CO) C1=CC=CC=C1

Molecular Formula

C9H12O2

Molecular Weight

152.19 g/mol

Controlled

Chemical Information

Benzeneethanol, beta-methoxy-

CAS Number	2979-22-8
PubChem CID	102910
IUPAC Name	2-methoxy-2-phenylethanol
Molecular Formula	C9H12O2
Molecular Weight	152.19
XLogP	0.9
Topological Polar Surface Area	29.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	11
Formal Charge	0
Complexity	97

SMILES

COC(CO)C1=CC=CC=C1

InChI

InChI=1S/C9H12O2/c1-11-9(7-10)8-5-3-2-4-6-8/h2-6,9-10H,7H2,1H3

InChIKey

JDTUPLBMGDDPJS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2979-22-8

CID: 102910

Formula: C9H12O2

MW: 152.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	152.19
XLogP3	0.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	152.083729621
Monoisotopic Mass	152.083729621
Topological Polar Surface Area	29.5 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	97.7
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
GAA27359	2- (Benzylamino) -2-phenylethanol
EAA44282-01	2-Cyclohexyl-1-phenylethanol
EAA24972-01	2-Phenoxy-1-phenylethanol
ZAA15547-01	2- (1-Imidazolyl) -1-phenylethanol
FA64085-01	(R) -2-Amino-1-phenylethanol
DAA49079-01	2-Methoxy-2-phenylethan-1-amine
TAA86743	(R) - (-) -2-Amino-1-phenylethanol hydrochloride
KWC45464-01	2-Methoxy-2-phenylethane-1-sulfonyl chloride
CDA18409-01	2- (N-Boc-N-methylamino) -1-phenylethanol
ZPC26101-01	(S) -2- ((4-Aminophenethyl) amino) -1-phenylethanol

Catalog	Name
sc-230456	2-Methoxy-2-phenylethanol
sc-229046	(R) - (-) -2-Methoxy-2-phenylethanol
AR-P01378-01	1-cyclopentyl-2-methoxy-1-phenylethanol
T0011	2-Phenylethanol
OR1064420-01	2-Phenoxy-2-phenylethanol
HY-B1290R-01	2-Phenylethanol (Standard)
HY-B1290S3	2-Phenylethanol-13C2
HY-B1290S2-01	2-Phenylethanol-d5
HY-B1290S	2-Phenylethanol-d4
HY-B1290S1	2-Phenylethanol-d9