Phenol, 4-heptyl-


Chemical Name: Phenol, 4-heptyl-
CAS Number: 1987-50-4
Product Number: AG002BPP(AGN-PC-0JKCPH)
Synonyms:
MDL No:
Molecular Formula: C13H20O
Molecular Weight: 192.2973

Identification/Properties


Properties
Storage:
Room Temperature;
Computed Properties
Molecular Weight:
192.302g/mol
XLogP3:
4.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
6
Exact Mass:
192.151g/mol
Monoisotopic Mass:
192.151g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
125
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:
Danger
UN#:
2430
Hazard Statements:
H314
Precautionary Statements:
P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P405-P501
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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