Home Amines 1269384-12-4
1269384-12-4,MFCD18483518
Catalog No.:AA00J21L
1269384-12-4 | 3-(3-aminophenyl)-N-methylpropanamide dihydrochloride
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Purity
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Price(USD)
Quantity
  
1g
95%
in stock  
$74.00   $52.00
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5g
95%
in stock  
$293.00   $205.00
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Technical Information
Catalog Number:
AA00J21L
Chemical Name:
3-(3-aminophenyl)-N-methylpropanamide dihydrochloride
CAS Number:
1269384-12-4
Molecular Formula:
C10H16Cl2N2O
Molecular Weight:
251.1528
MDL Number:
MFCD18483518
IUPAC Name:
3-(3-aminophenyl)-N-methylpropanamide;dihydrochloride
InChI:
InChI=1S/C10H14N2O.2ClH/c1-12-10(13)6-5-8-3-2-4-9(11)7-8;;/h2-4,7H,5-6,11H2,1H3,(H,12,13);2*1H
InChI Key:
RKCRJRKUWSBWRX-UHFFFAOYSA-N
SMILES:
CNC(=O)CCc1cccc(c1)N.Cl.Cl
Properties
Computed Properties
 
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.064g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
251.151g/mol
Monoisotopic Mass:
250.064g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
3-(3-AMINOPHENYL)-N-METHYLPROPANAMIDE DIHYDROCHLORIDE 
1269384-12-4 
ZX-CM007978 
MFCD18483518 
MCULE-9127316030 
1018542-66-9 
Literature
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