Benzoic acid, 2-chloro-4-(1-pyrrolidinyl)-, methyl ester


Chemical Name: Benzoic acid, 2-chloro-4-(1-pyrrolidinyl)-, methyl ester
CAS Number: 175153-38-5
Product Number: AG0020CY(AGN-PC-0KKPLZ)
Synonyms:
MDL No: MFCD03844850
Molecular Formula: C12H14ClNO2
Molecular Weight: 239.6981

Identification/Properties


Properties
MP:
133~135℃
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
239.699g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
239.071g/mol
Monoisotopic Mass:
239.071g/mol
Topological Polar Surface Area:
29.5A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
253
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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