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4-Benzyloxybenzaldehyde - 98%, high purity , CAS No.4397-53-9

≥98%

CAS#: 4397-53-9
Formula: C₁₄H₁₂O₂
Molecular Weight: 212.24
Beilstein Registry Number: 1242385
EC Number: 224-527-2
MDL number: MFCD00003387
PubChem CID: 78109

Item Number

B108010

Grouped product items
SKU	Size	Availability	Price
B108010-5g	5g	In stock	$12.90
B108010-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$19.90
B108010-25g	25g	In stock	$36.90
B108010-100g	100g	In stock	$100.90
B108010-500g	500g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$320.90

View related series

aldehyde Carbonyl compound

Basic Description

Synonyms	4-Benzyloxybenzaldehyde\|4-(Benzyloxy)benzaldehyde\|4397-53-9\|Benzaldehyde, 4-(phenylmethoxy)-\|4-phenylmethoxybenzaldehyde\|Benzaldehyde, p-(benzyloxy)-\|p-(Benzyloxy)benzaldehyde\|p-benzyloxybenzaldehyde\|4-Benzyloxy-benzaldehyde\|MFCD00003387\|4-(Phenylmethoxy)
Specifications & Purity	≥98%
Storage Temp	Store at 2-8°C,Argon charged
Shipped In	Wet ice
Product Description	4-(Benzyloxy)benzaldehyde was used in the synthesis of (5-fluoro-(2R,3S)-2,3-bis(4-hydroxyphenyl)pentanenitrile),an estrogen receptor β-selective ligand. 4-Benzyloxybenzaldehyde is used in the synthesis of (5-fluoro-(2R,3S)-2,3-bis(4-hydroxyphenyl)pentanenitrile),an estrogen receptor β-selective ligand. It is a position isomer of the adenylyl cyclase activator 2-benzyloxybenzaldehyde.

Associated Targets

SLC6A1 Tclin Sodium- and chloride-dependent GABA transporter 1 0 Activities

Discover Target: SLC6A1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

ADCY3 Tbio Adenylate cyclase type 3 0 Activities

Discover Target: ADCY3

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

Names and Identifiers

IUPAC Name	4-phenylmethoxybenzaldehyde
INCHI	InChI=1S/C14H12O2/c15-10-12-6-8-14(9-7-12)16-11-13-4-2-1-3-5-13/h1-10H,11H2
InChi Key	ZVTWZSXLLMNMQC-UHFFFAOYSA-N
Canonical SMILES	C1=CC=C(C=C1)COC2=CC=C(C=C2)C=O
Isomeric SMILES	C1=CC=C(C=C1)COC2=CC=C(C=C2)C=O
WGK Germany	3
PubChem CID	78109
Molecular Weight	212.24
Beilstein	1242385
Reaxy-Rn	1242385

Certificates

Certificate of Analysis(COA)

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7 results found

Lot Number	Certificate Type	Date	Item
G2426612	Certificate of Analysis	Jun 25, 2024	B108010
G2426613	Certificate of Analysis	Jun 25, 2024	B108010
J2229034	Certificate of Analysis	Sep 24, 2022	B108010
J2229071	Certificate of Analysis	Sep 24, 2022	B108010
J2229074	Certificate of Analysis	Sep 24, 2022	B108010
J2229075	Certificate of Analysis	Sep 24, 2022	B108010
B2225468	Certificate of Analysis	Jun 15, 2021	B108010

Solubility

Insoluble in water.

Sensitivity

Air sensitive

Boil Point(°C)

219°C/13mmHg

Melt Point(°C)

71-74°C

Safety and Hazards(GHS)

Pictogram(s)	GHS07
Signal	Warning
Hazard Statements	H315:Causes skin irritation H319:Causes serious eye irritation H335:May cause respiratory irritation H302:Harmful if swallowed
Precautionary Statements	P261:Avoid breathing dust/fume/gas/mist/vapors/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P271:Use only outdoors or in a well-ventilated area. P270:Do not eat, drink or smoke when using this product. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P362+P364:Take off contaminated clothing and wash it before reuse. P330:Rinse mouth. P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes. P301+P317:IF SWALLOWED: Get medical help. P337+P317:If eye irritation persists: Get medical help. P332+P317:If skin irritation occurs: Get medical help. P319:Get medical help if you feel unwell.
WGK Germany	3
Reaxy-Rn	1242385

References

1. Jeongsoo Yoo, Carmen S Dence, Terry L Sharp, John A Katzenellenbogen, Michael J Welch,. (2005-09-30) Synthesis of an estrogen receptor beta-selective radioligand: 5-[18F]fluoro-(2R,3S)-2,3-bis(4-hydroxyphenyl)pentanenitrile and comparison of in vivo distribution with 16alpha-[18F]fluoro-17beta-estradiol.. Journal of medicinal chemistry, 48 ((20)): ( 6366-6378 ). [PMID:16190762]

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