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MCPA-1-BUTYL ESTER

CAS No.:
1713-12-8
Catalog Number:
AG00APM6
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00APM6
Chemical Name:
MCPA-1-BUTYL ESTER
CAS Number:
1713-12-8
MDL Number:
MFCD00126848
IUPAC Name:
butyl 2-(4-chloro-2-methylphenoxy)acetate
InChI:
InChI=1S/C13H17ClO3/c1-3-4-7-16-13(15)9-17-12-6-5-11(14)8-10(12)2/h5-6,8H,3-4,7,9H2,1-2H3
InChI Key:
PKRRSPSPRIGHQE-UHFFFAOYSA-N
EC Number:
216-989-9
UNII:
D103H30012
Properties
Complexity:
233  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.087g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
256.726g/mol
Monoisotopic Mass:
256.087g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Properties