N,N-bis(prop-2-ynyl)aniline

Modify Date: 2025-10-11 16:58:22

N,N-bis(prop-2-ynyl)aniline Structure
N,N-bis(prop-2-ynyl)aniline structure
 Common Name N,N-bis(prop-2-ynyl)aniline
CAS Number 18158-68-4 Molecular Weight 169.22200
Density 1.051g/cm3 Boiling Point 258.7ºC at 760 mmHg
Molecular Formula C12H11N Melting Point N/A
MSDS N/A Flash Point 100.8ºC

 Names

Name N,N-bis(prop-2-ynyl)aniline
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.051g/cm3
Boiling Point 258.7ºC at 760 mmHg
Molecular Formula C12H11N
Molecular Weight 169.22200
Flash Point 100.8ºC
Exact Mass 169.08900
PSA 3.24000
LogP 1.75940
Vapour Pressure 0.0135mmHg at 25°C
Index of Refraction 1.595
InChIKey ONOQPVMGQVXXQD-UHFFFAOYSA-N
SMILES C#CCN(CC#C)c1ccccc1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
BX9400000
CHEMICAL NAME :
Aniline, N,N-di-2-propynyl-
CAS REGISTRY NUMBER :
18158-68-4
BEILSTEIN REFERENCE NO. :
2717680
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H11-N
MOLECULAR WEIGHT :
169.24
WISWESSER LINE NOTATION :
1UU2NR&2UU1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
56 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#05822

 Safety Information

HS Code 2921420090

 Customs

HS Code 2921420090
Summary HS:2921420090 aniline derivatives and their salts VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

 Synonyms

N,N-Di-prop-2-inyl-anilin
ANILINE,N,N-DI-2-PROPYNYL
Aniline,N-di-2-propynyl
N,N-dipropargylaniline
N,N-Di-2-propynylaniline
phenyl-di-prop-2-ynyl-amine
Dipropargylphenylamine
N,N-di-prop-2-ynyl-aniline
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