1- (2-Bromoethoxy) naphthalene

CAT: 0926-NAA24779-01Size: 0.5 gDry Ice: NoHazardous: No

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CAT#:0926-NAA24779-01Size:0.5 g

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CAS Number

13247-79-5

MDL Number

MFCD02030865

Smiles

C1=CC=C2C (=C1) C=CC=C2OCCBr

Molecular Formula

C12H11BrO

Molecular Weight

251.12 g/mol

Controlled

Chemical Information

1-(2-Bromoethoxy)naphthalene

CAS Number	13247-79-5
PubChem CID	11075906
IUPAC Name	1-(2-bromoethoxy)naphthalene
Molecular Formula	C12H11BrO
Molecular Weight	251.12
XLogP	4.4
Topological Polar Surface Area	9.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Heavy Atom Count	14
Formal Charge	0
Complexity	172

SMILES

C1=CC=C2C(=C1)C=CC=C2OCCBr

InChI

InChI=1S/C12H11BrO/c13-8-9-14-12-7-3-5-10-4-1-2-6-11(10)12/h1-7H,8-9H2

InChIKey

OBGFJKNQKBMXBM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 13247-79-5

CID: 11075906

Formula: C12H11BrO

MW: 251.12

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	251.12
XLogP3	4.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	3
Exact Mass	249.99933
Monoisotopic Mass	249.99933
Topological Polar Surface Area	9.2 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	172
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
NAA24780-01	2- (2-bromoethoxy) naphthalene
FB151131-01	2- (2-Bromoethoxy) -1-methoxybenzene
EAA96316-01	1- (2-Bromoethoxy) -2-methylpropane
TAA80032	1- (2-Bromoethoxy) -2-methylbenzene
TAA80037	1- (2-Bromoethoxy) -2-nitrobenzene
TAA80026-01	1- (2-bromoethoxy) -2-chlorobenzene
FDD52391-01	2- (2-Bromoethoxy) -1,1-difluorocyclopropane
ULC86104-01	2- (2-Bromoethoxy) -1,1-difluoroethane
DZB25841-01	2- (2-Bromoethoxy) -1,1-dimethoxyethane
XAA92176	1- (2-Bromoethoxy) -4-methoxybenzene

Catalog	Name
sc-334700	2- (2-bromoethoxy) naphthalene
OR1064880-01	1- (2-Bromoethoxy) naphthalene
TRC-C384808-5G	2-(Chloromethyl)naphthalene
TRC-N756615-500MG	Naphthalene-2-sulfonohydrazide
sc-269945	Naphthalene-2-carboxamide
PC1007236-01	2- (Difluoromethyl) naphthalene
OR1004025-01	Naphthalene-2-sulphonohydrazide
OR14019-01	Naphthalene-2-amidoxime
OR1009813-01	2- (Chloromethyl) Naphthalene
414095-01	2- (Bromomethyl) naphthalene