Home Other Building Blocks 2-CHLORO-3-(PROPAN-2-YLOXY)BENZOIC ACID

2-CHLORO-3-(PROPAN-2-YLOXY)BENZOIC ACID

CAS No.:
1369785-64-7
Catalog Number:
AG01DVYL
Molecular Formula:
C10H11ClO3
Molecular Weight:
214.6455
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Product Description
Catalog Number:
AG01DVYL
Chemical Name:
2-CHLORO-3-(PROPAN-2-YLOXY)BENZOIC ACID
CAS Number:
1369785-64-7
Molecular Formula:
C10H11ClO3
Molecular Weight:
214.6455
MDL Number:
MFCD28356777
IUPAC Name:
2-chloro-3-propan-2-yloxybenzoic acid
InChI:
InChI=1S/C10H11ClO3/c1-6(2)14-8-5-3-4-7(9(8)11)10(12)13/h3-6H,1-2H3,(H,12,13)
InChI Key:
NANUKPNCPFPTCJ-UHFFFAOYSA-N
SMILES:
CC(Oc1cccc(c1Cl)C(=O)O)C
Properties
Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.04g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
214.645g/mol
Monoisotopic Mass:
214.04g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties