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1,9-Nonanediol

1,9-Nonanediol structure

CAS No:
3937-56-2
Formula:
C9H20O2
Chemical Name:
1,9-Nonanediol
Synonyms:
1,9-Nonanediol;α,ω-Nonanediol;1,9-Dihydroxynonane;NSC 5416;Nonamethylene glycol
Categories:
Active Pharmaceutical Ingredients > Other Chemical Drugs

Description

white fused crystalline solid

1,9-Nonanediol is an aliphatic alcohol.|1,9-Nonanediol is an aliphatic alcohol (with nine carbon atoms and two hydroxyl groups at positions 1 and 9) used in chemical synthesis and biomedical research. 1,9-Nonanediol suppresses glycine currents in neurons; glycine is a major inhibitory neurotransmitter in the mature mammalian central nervous system. (NCI04)

1,9-Nonanediol Basic Attributes

Molecular Weight：

160.25

Exact Mass：

160.25

BRN：

1737531

EC Number：

223-517-5

UNII：

N4385C65C6

NSC Number：

5416

DSSTox ID：

DTXSID5063237

NCI Thesaurus Code：

C28777

HScode：

2905399090

Characteristics

PSA：

40.5

XLogP3：

2.2

Appearance：

White Fused Crystalline Solid

Density：

0.9±0.1 g/cm3

Melting Point：

45.8 °C

Boiling Point：

147-149 °C @ Press: 1 Torr

Flash Point：

>230 °F

Refractive Index：

1.456

Water Solubility：

soluble in methanol.

Storage Conditions：

Store below +30°C.

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

safety instructions：

22-24/25

Precautionary statement(s)：

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

Hazard Statements：

H315

GHS Classification：

|Warning|H315 (33.33%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 9 companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

1,9-nonanediol

1,9-Nonanediol Use and Manufacturing

Manufacturing Info：

1,9-Nonanediol: ACTIVE

Computed Properties

Molecular Weight:160.25
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:8
Exact Mass:160.146329876
Monoisotopic Mass:160.146329876
Topological Polar Surface Area:40.5
Heavy Atom Count:11
Complexity:56.6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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