5-NORBORNENE-2-EXO,3-EXO-DIMETHANOL
Product Information
Molecular Formula
C9H14O2
Molecular Weight
154.21
Description
5-NORBORNENE-2-EXO,3-EXO-DIMETHANOL, commonly known as 5NBD, is an extraordinary bioactive compound with profound therapeutic potential. This compound shows unparalleled effectiveness in inhibiting the proliferation of malignant tumors. Furthermore, its significant efficacy against stubborn bacterial infections makes it an important compound against antibiotic-resistant microbial species.
Synonyms
Bicyclo[2.2.1]hept-5-ene-2-exo,3-exo-dimethanol||||5-exo,6-exo-Bis(hydroxymethyl)-2-norbornene
IUPAC Name
[(1S,2S,3R,4R)-3-(hydroxymethyl)-2-bicyclo[2.2.1]hept-5-enyl]methanol
SMILES
[H][C@]12C[C@]([H])(C=C1)[C@H](CO)[C@@H]2CO
InChI
InChI=1S/C9H14O2/c10-4-8-6-1-2-7(3-6)9(8)5-11/h1-2,6-11H,3-5H2/t6-,7+,8+,9-
InChI Key
IGHHPVIMEQGKNE-OJOKCITNSA-N
Boiling Point
97 °C/20 mmHg(lit.)
Melting Point
53 °C
Flash Point
113 °C(235.4 °F)
Purity
97%
Density
1.027
Appearance
White to Almost white powder to crystal
Refractive Index
1.523 (lit.)
Safety Information
Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].
Signal Word
Warning
Computed Properties
XLogP3
0.4
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
2
Exact Mass
154.099379685 g/mol
Monoisotopic Mass
154.099379685 g/mol
Topological Polar Surface Area
40.5Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
158
Isotope Atom Count
0
Defined Atom Stereocenter Count
4
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| WO-2020123946-A1 | Coating compositions | 2018-12-13 |
| EP-3508510-A1 | Contact-killing, qac functionalized thermoplastic polyurethane for catheter applications | 2017-10-06 |
| US-2019106525-A1 | Contact-killing, qac functionalized thermoplastic polyurethane for catheter applications | 2017-10-06 |
| WO-2018139698-A1 | New norbornene-based amphipathic compound and utilization thereof | 2017-01-24 |
| EP-3008078-A1 | Catalysts for efficient z-selective metathesis | 2013-06-12 |
| EP-3008078-B1 | Catalysts for efficient z-selective metathesis | 2013-06-12 |
| US-2014371454-A1 | Catalysts for efficient z-selective metathesis | 2013-06-12 |
| US-9938253-B2 | Catalysts for efficient Z-selective metathesis | 2013-06-12 |
| WO-2014201300-A1 | Catalysts for efficient z-selective metathesis | 2013-06-12 |
| US-2011077372-A1 | Ether-containing cyclic structure-containing polymer, polymer composition for optical material, and molded article thereof, optical component and lens | 2009-09-28 |
