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26148-68-5

Basic Information
CAS No.: 26148-68-5
Name: 2-AMINO-9H-PYRIDO[2,3-B]INDOLE
Article Data: 1
Molecular Structure:
Molecular Structure of 26148-68-5 (2-AMINO-9H-PYRIDO[2,3-B]INDOLE)
Formula: C11H9 N3
Molecular Weight: 183.213
Synonyms: 1H-Pyrido[2,3-b]indol-2-amine(9CI); 9H-Pyrido[2,3-b]indole, 2-amino- (8CI); 2-Amino-9H-pyrido[2,3-b]indole;2-Amino-a-carboline; 9H-1,9-Diazafluoren-2-amine;AaC; AaC
Density: 1.393g/cm3
Melting Point: 194-196
Boiling Point: 440.9°Cat760mmHg
Flash Point: 250.7°C
Appearance: Crystalline Solid
Hazard Symbols:
Safety: Suspected carcinogen with experimental carcinogenic data. Human mutation data reported. When heated to decomposition it emits toxic fumes of NOx.
PSA: 54.70000
LogP: 2.87950
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Chemistry


IUPAC Name: 9H-pyrido[2,3-b]indol-2-amine 
Molecular Weight: 183.20926 g/mol
Molecular Formula: C11H9N3 
Density: 1.393 g/cm3 
Melting Point: 194-196 °C
Boiling Point: 440.9 °C at 760 mmHg 
Flash Point: 250.7 °C
Appreance: crystalline Solid
Molar Volume: 131.4 cm3
Polarizability: 23.26*10-24cm3
Surface Tension: 81 dyne/cm 
Enthalpy of Vaporization: 69.81 kJ/mol
Vapour Pressure: 5.68E-08 mmHg at 25 °C
XLogP3: 2.6
H-Bond Donor: 2
H-Bond Acceptor: 2
Tautomer Count: 6
Exact Mass: 183.079647
MonoIsotopic Mass: 183.079647
Topological Polar Surface Area: 54.7
Heavy Atom Count: 14
Complexity: 219
Canonical SMILES: C1=CC=C2C(=C1)C3=C(N2)N=C(C=C3)N
InChI: InChI=1S/C11H9N3/c12-10-6-5-8-7-3-1-2-4-9(7)13-11(8)14-10/h1-6H,(H3,12,13,14)
InChIKey: FJTNLJLPLJDTRM-UHFFFAOYSA-N
Product Categories: Detergents; Mutagenesis Research Chemicals

Uses

A pyrolysate that exhibited mutagenic activity toward Salmonella typhimurium TA98 and TA100 from the pyrolytic products of soybean globulin.

Toxicity Data With Reference

1.    

sce-hmn:lym 4000 µg/L

    MUREAV    Mutation Research. 77 (1980),65.
2.    

mmo-sat 1 µg/plate ABCHA6 43,1155,79

3.    

mma-sat 1 µg/plate

    CALEDQ    Cancer Letters (Shannon, Ireland). 10 (1980),141.
4.    

dnr-bcs 10 µL/plate ABCHA6 45,2031,81

5.    

slt-dmg-orl 400 ng/kg

    JJCREP    Japanese Journal of Cancer Research (Gann). 76 (1985),468.
6.    

orl-mus TDLo:37,600 mg/kg/98W-C:CAR

    EVHPAZ    EHP, Environmental Health Perspectives. Subseries of DHEW Publications. 67 (1986),129.
7.    

orl-mus TD:50,424 mg/kg/82W-C:CAR

    CRNGDP    Carcinogenesis. 5 (1984),815.

Consensus Reports

IARC Cancer Review: Group 2B IMEMDT    IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man . 7 (1987),p. 56.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) ; Animal Sufficient Evidence IMEMDT    IARC Monographs on the Evaluation of Carcinogenic Risk of Chemicals to Man . 40 (1986),p. 245.(World Health Organization, Internation Agency for Research on Cancer,Lyon, France.: ) (Single copies can be ordered from WHO Publications Centre U.S.A., 49 Sheridan Avenue, Albany, NY 12210) .

Safety Profile

Suspected carcinogen with experimental carcinogenic data. Human mutation data reported. When heated to decomposition it emits toxic fumes of NOx.
Hazard Codes: IrritantXi
RIDADR: 2811
Hazard Note: Irritant/Mutagen
HazardClass: 6.1(b)
PackingGroup: III

Specification

 Amino-&alpha;-carboline (CAS NO.26148-68-5) is also named 2-Amino-9h-pyrido[2,3-b]indole ; AC ; 1h-Pyrido(2,3-b)indol-2-amine ; 2-amino-alpha-carboline ; 2-amino-9h-pyridol[2,3-beta]indole ; 2-amino-9h-pyridol(2,3-b)indole . Amino-&alpha;-carboline (CAS NO.26148-68-5) is a kind of toxic substances. It is flammable. Amino-&alpha;-carboline (CAS NO.26148-68-5) will produce toxic nitrogen oxide fumes when buring. So the storage environment should be ventilate, low-temperature and dry.