Home Aminos 3,5-Diamino-4-methylbenzoic acid

3,5-Diamino-4-methylbenzoic acid

CAS No.:
6633-36-9
Catalog Number:
AG006NBQ
Molecular Formula:
C8H10N2O2
Molecular Weight:
166.1772
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
95%
In Stock USA
United States
$630
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Product Description
Catalog Number:
AG006NBQ
Chemical Name:
3,5-Diamino-4-methylbenzoic acid
CAS Number:
6633-36-9
Molecular Formula:
C8H10N2O2
Molecular Weight:
166.1772
MDL Number:
MFCD00025283
IUPAC Name:
3,5-diamino-4-methylbenzoic acid
InChI:
InChI=1S/C8H10N2O2/c1-4-6(9)2-5(8(11)12)3-7(4)10/h2-3H,9-10H2,1H3,(H,11,12)
InChI Key:
KNWUVCLZVAITFP-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(N)c(c(c1)N)C
NSC Number:
56684
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.074g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
166.18g/mol
Monoisotopic Mass:
166.074g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
89.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties