Home Other Building Blocks 2-BROMO-5-(DIMETHYLAMINO)BENZOIC ACID

2-BROMO-5-(DIMETHYLAMINO)BENZOIC ACID

CAS No.:
1035235-21-2
Catalog Number:
AG01C7KG
Molecular Formula:
C9H10BrNO2
Molecular Weight:
244.0852
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Product Description
Catalog Number:
AG01C7KG
Chemical Name:
2-BROMO-5-(DIMETHYLAMINO)BENZOIC ACID
CAS Number:
1035235-21-2
Molecular Formula:
C9H10BrNO2
Molecular Weight:
244.0852
MDL Number:
MFCD23726327
IUPAC Name:
2-bromo-5-(dimethylamino)benzoic acid
InChI:
InChI=1S/C9H10BrNO2/c1-11(2)6-3-4-8(10)7(5-6)9(12)13/h3-5H,1-2H3,(H,12,13)
InChI Key:
HICSXUAAJBEMKP-UHFFFAOYSA-N
SMILES:
CN(c1ccc(c(c1)C(=O)O)Br)C
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.989g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
244.088g/mol
Monoisotopic Mass:
242.989g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Properties