2-Benzyloxy-4-bromophenol

CAT: 0024-sc-503508Size: 500 mgDry Ice: NoHazardous: No

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CAT#:0024-sc-503508Size:500 mg

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CAS Number

153240-85-8

Chemical Information

2-(Benzyloxy)-4-bromophenol

CAS Number	153240-85-8
PubChem CID	21877514
IUPAC Name	4-bromo-2-phenylmethoxyphenol
Molecular Formula	C13H11BrO2
Molecular Weight	279.13
XLogP	3.7
Topological Polar Surface Area	29.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	16
Formal Charge	0
Complexity	204

SMILES

C1=CC=C(C=C1)COC2=C(C=CC(=C2)Br)O

InChI

InChI=1S/C13H11BrO2/c14-11-6-7-12(15)13(8-11)16-9-10-4-2-1-3-5-10/h1-8,15H,9H2

InChIKey

FCRCHBBRZJZSHO-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 153240-85-8

CID: 21877514

Formula: C13H11BrO2

MW: 279.13

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	279.13
XLogP3	3.7
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	277.99424
Monoisotopic Mass	277.99424
Topological Polar Surface Area	29.5 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	204
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-491997	2- ({[4- (benzyloxy) phenyl]amino}methyl) -4-bromophenol
sc-495134	2- ((E) -{[4- (benzyloxy) phenyl]imino}methyl) -4-bromophenol
sc-321457	2-Adamantyl-4-bromophenol
sc-254132	2-Amino-4-bromophenol
sc-299364	4-Amino-2-bromophenol
sc-321457A	2-Adamantyl-4-bromophenol
sc-335038	2-allyl-4-bromophenol
sc-259534	2-Borono-4-bromophenol
sc-280422	4-Bromophenol
sc-280422A	4-Bromophenol