Benzoic acid, 3-cyclopropyl-


Chemical Name: Benzoic acid, 3-cyclopropyl-
CAS Number: 1129-06-2
Product Number: AG003679(AGN-PC-0JP5WM)
Synonyms:
MDL No:
Molecular Formula: C10H10O2
Molecular Weight: 162.1852

Identification/Properties


Properties
BP:
312.2°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
162.188g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
162.068g/mol
Monoisotopic Mass:
162.068g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
184
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


NMR Spectrum


PNMR/3-CYCLOPROPYLBENZOIC_ACID-1129-06-2-hnmr.pdf

Other Analytical Data


POTHER/3-CYCLOPROPYLBENZOIC_ACID-1129-06-2-gc.pdf

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