4-phenylmethoxybenzaldehyde

CAT: 1731-AP KH 0054-01Size: 1 mgDry Ice: NoHazardous: No

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CAT#:1731-AP KH 0054-01Size:1 mg

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CAS Number

4397-53-9

MDL Number

MFCD00003387

Purity

0.95

Smiles

O=Cc1ccc (OCc2ccccc2) cc1

Shipping Conditions

Room temperature, no cold chain required

Chemical Information

Benzaldehyde, 4-(phenylmethoxy)-

CAS Number	4397-53-9
PubChem CID	78109
IUPAC Name	4-phenylmethoxybenzaldehyde
Molecular Formula	C14H12O2
Molecular Weight	212.24
XLogP	3.3
Topological Polar Surface Area	26.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Heavy Atom Count	16
Formal Charge	0
Complexity	201

SMILES

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

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

InChIKey

ZVTWZSXLLMNMQC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 4397-53-9

CID: 78109

Formula: C14H12O2

MW: 212.24

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	212.24
XLogP3	3.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Exact Mass	212.083729621
Monoisotopic Mass	212.083729621
Topological Polar Surface Area	26.3 Å²
Heavy Atom Count	16
Formal Charge	0
Complexity	201
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
GT HW 3451-01	3-methoxy-2-phenylmethoxybenzaldehyde
FH MW 0088-01	4- (4-bromophenyl) heptan-4-ol
AP KR 0507-01	4- (4-methoxyphenyl) -4-oxobutanoic acid
AL BW 1014-01	4,4,4-trifluorobutan-1-amine
AM UF H053-01	4- (4-methoxyphenyl) -3- (morpholin-4-ylmethyl) thian-4-ol
AM UF H059-01	4- (4-methoxyphenyl) -3- (morpholin-4-ylmethyl) thiepan-4-ol
FH 1G 0A18-01	4- (4-methylphenyl) sulfanylaniline
AQ A3 0172-01	4-acetyl-4-methylheptanedinitrile
KY UC 7153-01	2- (4-methylphenyl) -N- (4-morpholin-4-ylphenyl) quinazolin-4-amine
KY UC 7083-01	N- (4-morpholin-4-ylphenyl) -2- (4-nitrophenyl) quinazolin-4-amine

Catalog	Name
OR1038882-01	4-Methyl-2-phenylmethoxybenzaldehyde
OR91515-01	4-Methoxy-2-phenylmethoxybenzaldehyde
PC1024445-01	2-Bromo-6-fluoro-3-phenylmethoxybenzaldehyde
PC6412	4,4,4-Trifluorobutyl 4,4,4-trifluorobutanoate
PC5215	4,4,4,4',4',4'-Hexafluorovaline hydrochloride
OR1011273-01	4,4',4'',4'''-Methanetetrayltetrabenzaldehyde
OR1011238-01	4,4,4,4-Silanetetrayltetrabenzaldehyde
OR1011275-01	4,4',4'',4'''-Methanetetrayltetraphenol
PC4810-01	4,4,4,4',4',4'-Hexafluoro-DL-valine
PC450233-01	4,4,4,4',4',4'-Hexafluorovaline, ethyl ester