Home Aminos 2-(Ethylamino)-5-methylbenzoic acid

2-(Ethylamino)-5-methylbenzoic acid

CAS No.:
54675-17-1
Catalog Number:
AG00DAVT
Molecular Formula:
C10H13NO2
Molecular Weight:
179.2157
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
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Product Description
Catalog Number:
AG00DAVT
Chemical Name:
2-(Ethylamino)-5-methylbenzoic acid
CAS Number:
54675-17-1
Molecular Formula:
C10H13NO2
Molecular Weight:
179.2157
MDL Number:
MFCD07439743
IUPAC Name:
2-(ethylamino)-5-methylbenzoic acid
InChI:
InChI=1S/C10H13NO2/c1-3-11-9-5-4-7(2)6-8(9)10(12)13/h4-6,11H,3H2,1-2H3,(H,12,13)
InChI Key:
BBEOAXDWSOBKMN-UHFFFAOYSA-N
SMILES:
CCNc1ccc(cc1C(=O)O)C
Properties
Complexity:
182  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.095g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
179.219g/mol
Monoisotopic Mass:
179.095g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties