4-Vinylbenzylamine

CAT: 0127-OR315400-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR315400-01Size:250 mg

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CAS Number

50325-49-0

MDL Number

MFCD08704374

Purity

92%

Smiles

NCc1ccc(C=C)cc1

Chemical Information

4-Vinylbenzylamine (stabilized with MEHQ)

CAS Number	50325-49-0
PubChem CID	11073466
IUPAC Name	(4-ethenylphenyl)methanamine
Molecular Formula	C9H11N
Molecular Weight	133.19
XLogP	1.6
Topological Polar Surface Area	26
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Heavy Atom Count	10
Formal Charge	0
Complexity	101

SMILES

C=CC1=CC=C(C=C1)CN

InChI

InChI=1S/C9H11N/c1-2-8-3-5-9(7-10)6-4-8/h2-6H,1,7,10H2

InChIKey

WAVDSLLYAQBITE-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 50325-49-0

CID: 11073466

Formula: C9H11N

MW: 133.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	133.19
XLogP3	1.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	2
Exact Mass	133.089149355
Monoisotopic Mass	133.089149355
Topological Polar Surface Area	26 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	101
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
PC450233-01	4,4,4,4',4',4'-Hexafluorovaline, ethyl ester
PC5216	4,4,4,4',4',4'-Hexafluorovaline methyl ester hydrochloride
OR1030830-01	4,4',4'',4'''-Methanetetrayltetrabenzimidamide Tetrahydrochloride
PC5215	4,4,4,4',4',4'-Hexafluorovaline hydrochloride
PC6412	4,4,4-Trifluorobutyl 4,4,4-trifluorobutanoate
OR1026164-01	4,4',4''-Phosphanetriyltribenzaldehyde
OR92513-01	4,4',4''-Nitrilotribenzonitrile
OR1011240-01	4,4',4''-Trihydroxytriphenylmethane
OR1011273-01	4,4',4'',4'''-Methanetetrayltetrabenzaldehyde
OR1011238-01	4,4,4,4-Silanetetrayltetrabenzaldehyde

Catalog	Name
sc-476835	4-Vinylbenzylamine
25725310-500g	4,4'-Sulfonyldiphenol (4,4'-Dihydroxydiphenylsulfone)
AAA40687	4,4,4-Trifluorobutanal
sc-262190A	4,4,4-Trifluorobutyraldehyde
sc-262192	4,4,4-Trifluorocrotonamide
AR-D01197-01	4,4'- (4,4'-oxybis (4,1-phenylenesulfonyl) ) dianiline
HY-77910-01	4- (4-Bromophenyl) -4-hydroxypiperidine
QCA61952-01	4- (4-Bromophenyl) -4-dimethylaminocyclohexanone
QBA39487-01	4- (4-Chlorophenyl) -4-oxobutanenitrile
FN31014-01	4,4',4''-Nitrilotribenzoic acid