3-Pentanol, 2,2-dimethyl-


Chemical Name: 3-Pentanol, 2,2-dimethyl-
CAS Number: 3970-62-5
Product Number: AG003FBG(AGN-PC-0JKEY2)
Synonyms:
MDL No:
Molecular Formula: C7H16O
Molecular Weight: 116.20134

Identification/Properties


Properties
MP:
-70℃
BP:
135.0°C
Storage:
Room Temperature;Keep in dry area;
Form:
Liquid
Computed Properties
Molecular Weight:
116.204g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
116.12g/mol
Monoisotopic Mass:
116.12g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
61.3
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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#:
1987
Hazard Statements:
H226-H315-H319-H335
Precautionary Statements:
P210-P233-P240-P241-P242-P243-P261-P264-P271-P280-P303+P361+P353-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P370+P378-P403+P233+P235-P405-P501
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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