Home > Compound List > Compound details
2016-57-1 molecular structure
click picture or here to close

decan-1-amine

ChemBase ID: 108316
Molecular Formular: C10H23N
Molecular Mass: 157.29632
Monoisotopic Mass: 157.18304974
SMILES and InChIs

SMILES:
CCCCCCCCCCN
Canonical SMILES:
CCCCCCCCCCN
InChI:
InChI=1S/C10H23N/c1-2-3-4-5-6-7-8-9-10-11/h2-11H2,1H3
InChIKey:
MHZGKXUYDGKKIU-UHFFFAOYSA-N

Cite this record

CBID:108316 http://www.chembase.cn/molecule-108316.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
decan-1-amine
IUPAC Traditional name
N-decylamine
Synonyms
NDA
1-Aminodecane
Decylamine
decan-1-amine
n-DECYLAMINE
1-氨基癸烷
癸胺
CAS Number
2016-57-1
EC Number
217-957-7
MDL Number
MFCD00008149
Beilstein Number
1735220
PubChem SID
24867897
24893684
24858545
24858500
162095626
PubChem CID
8916

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 0.3418639  LogD (pH = 7.4) 0.7616404 
Log P 3.365852  Molar Refractivity 51.3984 cm3
Polarizability 20.73024 Å3 Polar Surface Area 26.02 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
12-14 °C(lit.) expand Show data source
12-14°C expand Show data source
Boiling Point
216-218 °C(lit.) expand Show data source
216-218°C expand Show data source
Flash Point
192.2 °F expand Show data source
89 °C expand Show data source
Density
0.787 g/ml expand Show data source
0.787 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
n20/D 1.436 expand Show data source
n20/D 1.436(lit.) expand Show data source
Hydrophobicity(logP)
4.097 expand Show data source
RTECS
HD6475000 expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
Toxic Toxic (T) expand Show data source
UN Number
2922 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
8 expand Show data source
Packing Group
3 expand Show data source
Risk Statements
22-24-34 expand Show data source
R:22-27-34 expand Show data source
Safety Statements
26-36/37/39-45 expand Show data source
S:27/28-29-36/37/39-45 expand Show data source
GHS Pictograms
GHS05 expand Show data source
GHS06 expand Show data source
GHS09 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H301 + H311-H314-H400 expand Show data source
GHS Precautionary statements
P273-P280-P301 + P310-P305 + P351 + P338-P310 expand Show data source
Personal Protective Equipment
Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter expand Show data source
RID/ADR
UN 2922 8/PG 3 expand Show data source
Purity
≥98.0% (GC) expand Show data source
95% expand Show data source
95+% expand Show data source
Grade
analytical standard expand Show data source
purum expand Show data source
Certificate of Analysis
Download expand Show data source
Packaging
ampule of 1000 mg expand Show data source
Impurities
≤0.2% water expand Show data source
Linear Formula
CH3(CH2)9NH2 expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Sigma Aldrich Sigma Aldrich
MP Biomedicals - 05206900 external link
MP Biomedicals Rare Chemical collection
Sigma Aldrich - D2404 external link
Packaging
5, 25 g in glass bottle
Sigma Aldrich - 30692 external link
Packaging
5, 25 mL in glass bottle

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle