Home Aminos 3,5-Bis(aminomethyl)benzoic acid dihydrochloride

3,5-Bis(aminomethyl)benzoic acid dihydrochloride

CAS No.:
185963-32-0
Catalog Number:
AG00AO80
Molecular Formula:
C9H14Cl2N2O2
Molecular Weight:
253.1257
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$291
- +
Product Description
Catalog Number:
AG00AO80
Chemical Name:
3,5-Bis(aminomethyl)benzoic acid dihydrochloride
CAS Number:
185963-32-0
Molecular Formula:
C9H14Cl2N2O2
Molecular Weight:
253.1257
MDL Number:
MFCD28144945
IUPAC Name:
3,5-bis(aminomethyl)benzoic acid;dihydrochloride
InChI:
InChI=1S/C9H12N2O2.2ClH/c10-4-6-1-7(5-11)3-8(2-6)9(12)13;;/h1-3H,4-5,10-11H2,(H,12,13);2*1H
InChI Key:
BKJBHQXEYLPXTQ-UHFFFAOYSA-N
SMILES:
NCc1cc(CN)cc(c1)C(=O)O.Cl.Cl
Properties
Complexity:
173  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.043g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
253.123g/mol
Monoisotopic Mass:
252.043g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
89.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties