Home Amines 618-56-4
618-56-4,MFCD00150109
Catalog No.:AA003IHV
618-56-4 | 3,5-Diaminobenzoic acid diHCl
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25g
>98.0%(T)(HPLC)
1 week  
$103.00   $72.00
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Technical Information
Catalog Number:
AA003IHV
Chemical Name:
3,5-Diaminobenzoic acid diHCl
CAS Number:
618-56-4
Molecular Formula:
C7H10Cl2N2O2
Molecular Weight:
225.0725
MDL Number:
MFCD00150109
IUPAC Name:
3,5-diaminobenzoic acid;dihydrochloride
InChI:
InChI=1S/C7H8N2O2.2ClH/c8-5-1-4(7(10)11)2-6(9)3-5;;/h1-3H,8-9H2,(H,10,11);2*1H
InChI Key:
IGPLRBRBTUNCRT-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(N)cc(c1)N.Cl.Cl
EC Number:
210-556-8
Properties
Computed Properties
 
Complexity:
151  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.012g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
5  
Isotope Atom Count:
0
Molecular Weight:
225.069g/mol
Monoisotopic Mass:
224.012g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
89.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Synonyms
 
3,5-Diaminobenzoic acid dihydrochloride 
618-56-4 
3,5-DiaminobenzoicAcidDihydrochloride 
TRA0002372 
benzoic acid, 3,5-diamino- dihydrochloride 
DB-054009 
TC-122712 
TL8003963 
D0079 
FT-0632586 
KS-00001217 
3,5- DIAMINO BENZOIC ACID DIHYDROCHLORIDE 
3,5-Diaminobenzoic acid dihydrochloride, 99% 
3,5-Diaminobenzoic acid 
C7H8N2O2.2ClH 
3,5-Diaminobenzoesaure 2 HCl 
C7-H8-N2-O2.2Cl-H 
EINECS 210-556-8 
NSC 57806 
3,5-Diaminobenzoesaure-Dihydrochlorid 
AI3-51087 
BENZOIC ACID, 3,5-DIAMINO-, DIHYDROCHLORIDE 
Benzoic acid, 3,5-diamino-, hydrochloride (1:2) 
ACMC-1B2S7 
3,5-Diaminobenzoic acid diHCl 
SCHEMBL4295557 
CTK7I7021 
ANW-33967 
MFCD00012983 
Literature
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