[3- (Dimethoxymethyl) phenyl]methanamine

CAT: 0926-ZEA28346-01Size: 100 mgDry Ice: NoHazardous: No

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CAT#:0926-ZEA28346-01Size:100 mg

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CAS Number

124283-46-1

MDL Number

MFCD31583420

Smiles

COC (C1=CC=CC (=C1) CN) OC

Molecular Formula

C10H15NO2

Molecular Weight

181.23 g/mol

Controlled

Chemical Information

3-(Dimethoxymethyl)benzenemethanamine

CAS Number	124283-46-1
PubChem CID	84768464
IUPAC Name	[3-(dimethoxymethyl)phenyl]methanamine
Molecular Formula	C10H15NO2
Molecular Weight	181.23
XLogP	0.4
Topological Polar Surface Area	44.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Heavy Atom Count	13
Formal Charge	0
Complexity	137

SMILES

COC(C1=CC=CC(=C1)CN)OC

InChI

InChI=1S/C10H15NO2/c1-12-10(13-2)9-5-3-4-8(6-9)7-11/h3-6,10H,7,11H2,1-2H3

InChIKey

DTAAATXSAJQACD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 124283-46-1

CID: 84768464

Formula: C10H15NO2

MW: 181.23

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	181.23
XLogP3	0.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	181.110278721
Monoisotopic Mass	181.110278721
Topological Polar Surface Area	44.5 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	137
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
HWC43685-01	[2- (Dimethoxymethyl) phenyl]methanamine
JNA01920-01	[5- (Dimethoxymethyl) -2-fluorophenyl]methanamine
RQB50913-01	(3-Methanesulfonylphenyl) (phenyl) methanamine
KKB26881-01	[3- (Ethylsulfanyl) phenyl]methanamine
FCA09525-01	(3-Fluorophenyl) (phenyl) methanamine
TLB81095-01	[3- (Difluoromethyl) phenyl]methanamine
WFB57334-01	(3- (pentafluorothio) phenyl) methanamine
DNB71749	[3- (Cyclopentyloxy) phenyl]methanamine
VTB02468-01	[3- (3-Methoxypropoxy) phenyl]methanamine
BXB55292-01	[3- (3-Methylphenyl) phenyl]methanamine

Catalog	Name
OR1049588-01	[4- (Dimethoxymethyl) phenyl]methanamine
FH TL 00H1-01	1-[2-[4-[N- (2-acetylphenyl) -2- (dimethoxymethyl) anilino]-N-[2- (dimethoxymethyl) phenyl]anilino]phenyl]ethanone
FH HB 0013-01	Bis[2- (dimethoxymethyl) phenyl]- (2-phenylphenyl) methanol
FH HB 0004-01	9,9-bis[2- (dimethoxymethyl) phenyl]fluorene
sc-317758	5- (Chloromethyl) -3-[4- (dimethoxymethyl) phenyl]-1,2,4-oxadiazole
sc-317756	5- (Chloromethyl) -3-[3- (dimethoxymethyl) phenyl]-1,2,4-oxadiazole
OR346116-01	5-Dimethoxymethyl-1-phenyl-1H-pyrazole-4-carboxylic acid methyl ester
OR1069858-01	2- (4- (Dimethoxymethyl) phenyl) -4,4,5,5-tetramethyl-1,3,2-dioxaborolane
OR1032808-01	4- (Dimethoxymethyl) -1- (4- (4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl) phenyl) piperidine
PC1026235-01	Phenyl (4- (trifluoromethyl) phenyl) methanamine