3- (4-Bromophenyl) -3-methoxyoxetane

CAT: 0926-NYC65425-01Size: 50 mgDry Ice: NoHazardous: No

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CAT#:0926-NYC65425-01Size:50 mg

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CAS Number

1838654-25-3

MDL Number

MFCD30803338

Smiles

COC1 (COC1) C2=CC=C (C=C2) Br

Molecular Formula

C10H11BrO2

Molecular Weight

243.1 g/mol

Controlled

Chemical Information

3-(4-Bromophenyl)-3-methoxyoxetane

CAS Number	1838654-25-3
PubChem CID	117550942
IUPAC Name	3-(4-bromophenyl)-3-methoxyoxetane
Molecular Formula	C10H11BrO2
Molecular Weight	243.10
XLogP	1.7
Topological Polar Surface Area	18.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Heavy Atom Count	13
Formal Charge	0
Complexity	172

SMILES

COC1(COC1)C2=CC=C(C=C2)Br

InChI

InChI=1S/C10H11BrO2/c1-12-10(6-13-7-10)8-2-4-9(11)5-3-8/h2-5H,6-7H2,1H3

InChIKey

WYSLNMIJAZJSNT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1838654-25-3

CID: 117550942

Formula: C10H11BrO2

MW: 243.10

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	243.10
XLogP3	1.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	241.99424
Monoisotopic Mass	241.99424
Topological Polar Surface Area	18.5 Å²
Heavy Atom Count	13
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
MTB41599-01	3- (4-Bromophenyl) tetrahydrofuran
EKA89291-01	3- (4-Bromophenyl) cyclobutanone
IXB04751-01	3- (4-Bromophenyl) cyclobutanol
AZB82306-01	3- (4-Bromophenyl) morpholine
RLB79228-01	4- (3-Bromophenyl) pyrazole
QBA64171-01	3- (4-Bromophenyl) aniline
CGC15849-01	3- (4-Bromophenyl) oxetane
SDC56588-01	4- (4-Bromophenyl) -3-methylaniline
DAA40897-01	1- (4-Bromophenyl) -3,3-dimethylurea
FBA21650-01	4- (3-Bromophenyl) -1,3-thiazole

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