CAS 2835-98-5 | 2-Amino-5-methylphenol | CAS Number 2835-98-5

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2835-98-5 | 2-Amino-5-methylphenol

CAS No: 2835-98-5 Catalog No: AG003GHE MDL No:MFCD00007693

Product Description

Catalog Number:

AG003GHE

Chemical Name:

2-Amino-5-methylphenol

CAS Number:

2835-98-5

Molecular Formula:

C7H9NO

Molecular Weight:

123.1525

MDL Number:

MFCD00007693

IUPAC Name:

2-amino-5-methylphenol

InChI:

InChI=1S/C7H9NO/c1-5-2-3-6(8)7(9)4-5/h2-4,9H,8H2,1H3

InChI Key:

HCPJEHJGFKWRFM-UHFFFAOYSA-N

SMILES:

Cc1ccc(c(c1)O)N

EC Number:

220-620-7

UNII:

QCG4ES2A26

NSC Number:

322874

Properties

Complexity:

94.9

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

123.068g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

123.155g/mol

Monoisotopic Mass:

123.068g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

46.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2

Literature

Title	Journal
Peculiarity of methoxy group-substituted phenylhydrazones in Fischer indole synthesis.	Proceedings of the Japan Academy. Series B, Physical and biological sciences 20120111
2-[(Naphthalen-1-yl-methyl-idene)amino]-5-methyl-phenol.	Acta crystallographica. Section E, Structure reports online 20110901
2-Aminophenoxazine-3-one and 2-amino-4,4α-dihydro-4α,7-dimethyl-3H-phenoxazine-3-one cause cellular apoptosis by reducing higher intracellular pH in cancer cells.	Proceedings of the Japan Academy. Series B, Physical and biological sciences 20110511
Vibrational spectroscopy investigation using ab initio and density functional theory analysis on the structure of 2-amino-5-methylphenol.	Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20070601
Effect of natural phenol derivatives on skeletal type sarcoplasmic reticulum Ca2+ -ATPase and ryanodine receptor.	Journal of muscle research and cell motility 20070101
A novel kinetic determination of dissolved chromium species in natural and industrial waste water.	Talanta 20060915
Prediction of genotoxicity of chemical compounds by statistical learning methods.	Chemical research in toxicology 20050601
Final report on the safety assessment of 6-Amino-m-Cresol, 6-Amino-o-Cresol, 4-Amino-m-Cresol, 5-Amino-4-Chloro-o-Cresol, 5-Amino-6-Chloro-o-Cresol, and 4-Chloro-2-Aminophenol.	International journal of toxicology 20040101
Antiviral activity of 2-amino-4,4alpha-dihydro-4alpha-7-dimethyl-3H-phenoxazine-3-one on poliovirus.	The Tohoku journal of experimental medicine 20030701
A novel phenoxazine derivative suppresses proliferation of human endometrial adenocarcinoma cell lines, inducing G2M accumulation and apoptosis.	Oncology reports 20030101
A novel meta-cleavage dioxygenase that cleaves a carboxyl-group-substituted 2-aminophenol. Purification and characterization of 4-amino-3-hydroxybenzoate 2,3-dioxygenase from Bordetella sp. strain 10d.	European journal of biochemistry 20021201
Antitumor activity of a phenoxazine compound, 2-amino-4,4alpha-dihydro-4alpha,7-dimethyl-3H-phenoxazine-3-one against human B cell and T cell lymphoblastoid cell lines: induction of mixed types of cell death, apoptosis, and necrosis.	Journal of cancer research and clinical oncology 20020701
An improved method for the rapid preparation of 2-amino-4,4a-dihydro-4a,7-dimethyl-3H-phenoxazine-3-one, a novel antitumor agent.	Bioorganic & medicinal chemistry letters 20010423
Prevention of growth of human lung carcinoma cells and induction of apoptosis by a novel phenoxazinone, 2-amino-4,4alpha-dihydro-4alpha,7-dimethyl-3H-phenoxazine-3-one.	Anti-cancer drugs 20010401
Antitumor effects of a novel phenoxazine derivative on human leukemia cell lines in vitro and in vivo.	Clinical cancer research : an official journal of the American Association for Cancer Research 20010301