3-Cyanobenzoic acid
Quantity
Unit
CAS #
1877-72-1
PRODUCT
SYNONYM
3-CYANOBENZOIC ACID; EINECS 217-511-1; Benzoic acid, m-cyano-; Benzoic acid, 3-cyano-; UNII-D2GC692D78; 3-CARBOXYBENZONITRILE; m-Carboxybenzonitrile; M-CYANOBENZOIC ACID; 3-Cyano Benzoic Acid m-Cyano Benzoic Acid; ISOPHTHALIC ACID MONONITRILE
Show More
Show Less
FORMULA
C8H5NO2
MOLECULAR WEIGHT
147.13
EINECS
217-511-1
SMILES
c1(cc(ccc1)C#N)C(O)=O
INCHI
1S/C8H5NO2/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4H,(H,10,11)
INCHIKEY
GYLKKXHEIIFTJH-UHFFFAOYSA-N
WATER SOLUBILITY
2310 mg/L
LOG P (OCTANOL-WATER)
1.48
MELTING POINT
219 ° C
ATMOSPHERIC OH RATE CONSTANT
6.47E-13 cm3/molecule-sec
PKA DISSOCIATION CONSTANT
3.6
VAPOR PRESSURE
2.09E-04 mm Hg
HENRY'S LAW CONSTANT
1.05E-09 atm-m3/mole
STORAGE TEMPERATURE
Store at room temperature.
220-224 °C
BRN NUMBER
1862566
CLASS
Specialty Chemicals
Product Selections Have Been Added To Your Quote. Click Here To View Your Quote/Sample Request.
Looking for another product? Get a quick quote now!
Enter a chemical name, synonym or CAS# below to search