DL-Phenylglycinol

CAT: 0024-sc-357345ASize: 25 gDry Ice: NoHazardous: No

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CAT#:0024-sc-357345ASize:25 g

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CAS Number

7568-92-5

Chemical Information

2-Amino-2-phenylethanol

a beta2 adrenoceptor agonist

CAS Number	7568-92-5
PubChem CID	92466
IUPAC Name	2-amino-2-phenylethanol
Molecular Formula	C8H11NO
Molecular Weight	137.18
XLogP	0.1
Topological Polar Surface Area	46.3
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	10
Formal Charge	0
Complexity	89

SMILES

C1=CC=C(C=C1)C(CO)N

InChI

InChI=1S/C8H11NO/c9-8(6-10)7-4-2-1-3-5-7/h1-5,8,10H,6,9H2

InChIKey

IJXJGQCXFSSHNL-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 7568-92-5

CID: 92466

Formula: C8H11NO

MW: 137.18

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	137.18
XLogP3	0.1
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	137.084063974
Monoisotopic Mass	137.084063974
Topological Polar Surface Area	46.3 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	89.3
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
5-07747	DL-Phenylglycinol
abx184012-01	DL-2-phenylglycinol
OR929831-01	N-Boc-DL-Phenylglycinol
SCA34101	N- (tert-Butoxycarbonyl) -DL-2-phenylglycinol
HY-W002038-01	(-) -Phenylglycinol
286866-01	L-Phenylglycinol
56613-80-0	D-Phenylglycinol
TYD-00033-01	(S) - (+) -2-Phenylglycinol
90029563	R) - (-) -2-Phenylglycinol
277675-01	Fmoc-L-Phenylglycinol