Home Bromides 101-55-3
101-55-3,MFCD00000094
Catalog No.:AA0003DF
101-55-3 | 1-Bromo-4-phenoxybenzene
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5g
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$11.00   $8.00
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25g
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$29.00   $20.00
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100g
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500g
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  • Technical Information
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  • Technical Information
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Technical Information
Catalog Number:
AA0003DF
Chemical Name:
1-Bromo-4-phenoxybenzene
CAS Number:
101-55-3
Molecular Formula:
C12H9BrO
Molecular Weight:
249.1033
MDL Number:
MFCD00000094
IUPAC Name:
1-bromo-4-phenoxybenzene
InChI:
InChI=1S/C12H9BrO/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9H
InChI Key:
JDUYPUMQALQRCN-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)Oc1ccccc1
EC Number:
202-952-4
UNII:
N19SE3QCFN
NSC Number:
5619
UN Number:
3082
Properties
Computed Properties
 
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.984g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.107g/mol
Monoisotopic Mass:
247.984g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4  

Synonyms
 
4-bromodiphenyl ether 
1-Bromo-4-phenoxybenzene 
4-Bromodiphenylether 
CID7565 
AR-1L1673 
ACN-042415 
Benzene, 1,1'-oxybis-, monobromo (4-) 
2050-47-7 
209624-07-7 
p-Bromophenoxybenzene 
Ether, p-bromophenyl phenyl 
Phenyl ether, 4-bromo- 
Diphenyl ether, 4-bromo- 
Ether, 4-bromophenyl phenyl 
p-(Phenoxy)bromobenzene 
UNII-N19SE3QCFN 
NSC 5619 
4-Bromodiphenyl ether, 99% 
101-55-3 
Phenyl (4-bromophenyl) ether 
4-Phenoxy-1-bromobenzene 
N19SE3QCFN 
1-bromo-4-phenoxy-benzene 
CHEBI:77421 
JDUYPUMQALQRCN-UHFFFAOYSA-N 
MFCD00000094 
4-bromo-1-phenoxybenzene 
DSSTox_CID_3927 
DSSTox_RID_77232 
4-Bromodiphenyl ether 
DSSTox_GSID_23927 
PBDE 3 (4-Bromodiphenyl Ether) 
CAS-101-55-3 
4-Bromophenyl phenylether 
HSDB 2747 
EINECS 202-952-4 
4-phenoxybromobenzene 
4-bromodiphenyl oxide 
PubChem1903 
p-Phenoxyphenyl bromide 
4-Bromophenyl phenyl ether 
AI3-23460 
p-Bromphenyl phenyl ether 
1-bromo-4-phenoxy-benzen 
RCRA waste no. U030 
ACMC-2097vt 
PBDE No. 3 
4-BROMODIPHENYLOXIDE 
AC1L1P1V 
AC1Q26XA 
BDE-3 
4-Bromophenoxybenzene 
1-bromanyl-4-phenoxy-benzene 
SCHEMBL314422 
CHEMBL1873236 
DTXSID8023927 
JDUYPUMQALQRCN-UHFFFAOYSA- 
NSC5619 
ZINC404311 
AC1Q2500 
CS-M1054 
NSC-5619 
p-Bromodiphenyl ether 
Ether, p-bromophenyl phenyl (8CI) 
Tox21_201269 
Tox21_300512 
ANW-14487 
SBB061476 
AKOS005207110 
LS10419 
MCULE-7788431437 
PS-7501 
KS-00000O06 
p-Phenoxybromobenzene 
NCGC00164213-01 
NCGC00164213-02 
NCGC00164213-03 
NCGC00254405-01 
NCGC00258821-01 
AC-22960 
AC-23584 
AJ-22319 
AK116031 
L663 
Benzene, 1-bromo-4-phenoxy- 
PBDE No. 3 100 microg/mL in Methanol 
SC-27865 
ZB013463 
RT-000680 
B0637 
FT-0617888 
ST50408826 
K-0237 
A800403 
I01-4347 
P-BROMOPHENYL PHENYL ETHER 
J-000428 
UNII-54J1HY6KA8 component JDUYPUMQALQRCN-UHFFFAOYSA-N 
BDE No 3 solution, 50 mug/mL in isooctane, analytical standard 
InChI=1/C12H9BrO/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9H 
4-bromphenylphenylether 
4-Bromo diphenyl ether 
1-Bromo-4-phenyoxy benzene 
Benceno, 1-bromo-4-fenoxi- 
Bromophenyl phenyl ether, 4- 
C12-H9-Br-O 
Literature

Title: Biphenyl and ethylbenzene dioxygenases of Rhodococcus jostii RHA1 transform PBDEs.

Journal: Biotechnology and bioengineering 20110201

Title: Photodegradation of 2,2',4,4'-tetrabromodiphenyl ether in nonionic surfactant solutions.

Journal: Chemosphere 20081101

Title: Synthesis and evaluation of a novel fluorescent photoprobe for imaging matrix metalloproteinases.

Journal: Bioconjugate chemistry 20080501

Title: Different reaction mechanisms of diphenylether and 4-bromodiphenylether with nitrous acid in the 355 nm laser flash photolysis of mixed aqueous solution.

Journal: Chemosphere 20080401

Title: Effects of fluoro substitution on 4-bromodiphenyl ether (PBDE 3).

Journal: Acta crystallographica. Section B, Structural science 20080201

Title: Antifouling activity of sponge-derived polybrominated diphenyl ethers and synthetic analogues.

Journal: Biofouling 20080101

Title: Gas-phase reactions of brominated diphenyl ethers with OH radicals.

Journal: The journal of physical chemistry. A 20060921

Title: Screening the oxidative potential of several mono- and di-halogenated biphenyls and biphenyl ethers in rat hepatocytes.

Journal: Combinatorial chemistry & high throughput screening 20060701

Title: Synthesis of new aliphatic and aromatic phytotoxic derivatives of 2alpha,4alpha-dimethyl-8-oxabicyclo[3.2.1]oct-6-en-3-one.

Journal: Pest management science 20030901

Title: Anaerobic microbial and photochemical degradation of 4,4'-dibromodiphenyl ether.

Journal: Water research 20030201

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