(R)-3-Amino-1,2,3,4-tetrahydrocarbazole - CAS 116650-33-0

Catalog:	BB003783
Product Name:	(R)-3-Amino-1,2,3,4-tetrahydrocarbazole
CAS:	116650-33-0
Synonyms:	(3R)-2,3,4,9-tetrahydro-1H-carbazol-3-amine; (3R)-2,3,4,9-tetrahydro-1H-carbazol-3-amine

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Computed Properties

IUPAC Name:	(3R)-2,3,4,9-tetrahydro-1H-carbazol-3-amine
Description:	(R)-3-Amino-1,2,3,4-tetrahydrocarbazole (CAS# 116650-33-0 ) is a useful research chemical.
Molecular Weight:	186.25
Molecular Formula:	C12H14N2
Canonical SMILES:	C1CC2=C(CC1N)C3=CC=CC=C3N2
InChI:	InChI=1S/C12H14N2/c13-8-5-6-12-10(7-8)9-3-1-2-4-11(9)14-12/h1-4,8,14H,5-7,13H2/t8-/m1/s1
InChI Key:	UFRCIKMHUAOIAT-MRVPVSSYSA-N
Boiling Point:	362.512 °C at 760 mmHg
Density:	1.192 g/cm³
Appearance:	White powder
LogP:	2.68420

Publication Number	Title	Priority Date
US-2021253579-A1	Polymorphic compounds and uses thereof	20191126
WO-2021108528-A1	Polymorphic carbazole derivatives and uses thereof	20191126
CN-113272305-A	Indole AHR inhibitors and uses thereof	20181016
KR-20210110566-A	Indole AHR inhibitors and uses thereof	20181016
CA-3059939-A1	Indole ahr inhibitors and uses thereof	20170421

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Related Functional Groups

Carbazoles

[1427316-58-2]
N-([1,1'-Biphenyl]-4-yl)-9-phenyl-9H-carbazol-2-amine
[1208005-83-7]
Bis(9,9-dimethyl-9H-fluoren-2-yl)diphenylsilane
[1060735-14-9]
9-Phenyl-9H,9'H-[3,3']bicarbazolyl
[1469700-24-0]
2,3,4,5,6-Penta(9H-carbazol-9-yl)benzonitrile
[2665768-26-1]
9-(3-(Triphenylsilyl)phenyl)-9h-3,9'-bicarbazole
[438219-61-5]
2-(1,2,3,4-Tetrahydro-9H-carbazol-9-yl)acetohydrazide

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, and P501
Signal Word:	Danger

Complexity:	216
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	186.115698455
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	186.115698455
Rotatable Bond Count:	0
Topological Polar Surface Area:	41.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.9