CAS 1196-92-5 | Phenol, 4-(aminomethyl)-2-methoxy- | CAS Number 1196-92-5

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1196-92-5 | Phenol, 4-(aminomethyl)-2-methoxy-

CAS No: 1196-92-5 Catalog No: AG000P93 MDL No:MFCD00044577

Product Description

Catalog Number:

AG000P93

Chemical Name:

Phenol, 4-(aminomethyl)-2-methoxy-

CAS Number:

1196-92-5

Molecular Formula:

C8H11NO2

Molecular Weight:

153.1784

MDL Number:

MFCD00044577

IUPAC Name:

4-(aminomethyl)-2-methoxyphenol

InChI:

InChI=1S/C8H11NO2/c1-11-8-4-6(5-9)2-3-7(8)10/h2-4,10H,5,9H2,1H3

InChI Key:

WRPWWVNUCXQDQV-UHFFFAOYSA-N

SMILES:

COc1cc(CN)ccc1O

EC Number:

422-450-0

UNII:

1WEZ91E3Z0

Properties

Complexity:

119

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

153.079g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

153.181g/mol

Monoisotopic Mass:

153.079g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.2

Literature

Title	Journal
Functional validation of Capsicum frutescens aminotransferase gene involved in vanillylamine biosynthesis using Agrobacterium mediated genetic transformation studies in Nicotiana tabacum and Capsicum frutescens calli cultures.	Plant science : an international journal of experimental plant biology 20121001
Synthesis of stable isotope-labeled precursors for the biosyntheses of capsaicinoids, capsinoids, and capsiconinoids.	Bioscience, biotechnology, and biochemistry 20110101
Understanding and classifying metabolite space and metabolite-likeness.	PloS one 20110101
Influence of 'remote' intramolecular hydrogen bonds on the stabilities of phenoxyl radicals and benzyl cations.	The Journal of organic chemistry 20100702
Functional loss of pAMT results in biosynthesis of capsinoids, capsaicinoid analogs, in Capsicum annuum cv. CH-19 Sweet.	The Plant journal : for cell and molecular biology 20090901
In vitro hepatic and skin metabolism of capsaicin.	Drug metabolism and disposition: the biological fate of chemicals 20080401
Enzymatic synthesis of capsaicin analogs and their effect on the T-type Ca2+ channels.	Biochemical and biophysical research communications 20070504
Genetic control of pungency in C. chinense via the Pun1 locus.	Journal of experimental botany 20070101
Valine pathway is more crucial than phenyl propanoid pathway in regulating capsaicin biosynthesis in Capsicum frutescens mill.	Journal of agricultural and food chemistry 20060906
Capsinoid is biosynthesized from phenylalanine and valine in a non-pungent pepper, Capsicum annuum L. cv. CH-19 sweet.	Bioscience, biotechnology, and biochemistry 20060601
Influence of 8-methyl-nonenoic acid on capsaicin biosynthesis in in-vivo and in-vitro cell cultures of Capsicum spp.	Journal of agricultural and food chemistry 20060308
Utilization of capsaicin and vanillylamine as growth substrates by Capsicum (hot pepper)-associated bacteria.	Environmental microbiology 20060301
Apoptosis induction by dohevanil, a DHA substitutive analog of capsaicin, in MCF-7 cells.	Life sciences 20060223
A novel acylase from Streptomyces mobaraensis that efficiently catalyzes hydrolysis/synthesis of capsaicins as well as N-acyl-L-amino acids and N-acyl-peptides.	Journal of agricultural and food chemistry 20060111
The Pun1 gene for pungency in pepper encodes a putative acyltransferase.	The Plant journal : for cell and molecular biology 20050601
Methyl jasmonate modulated biotransformation of phenylpropanoids to vanillin related metabolites using Capsicum frutescens root cultures.	Plant physiology and biochemistry : PPB 20050201
Quantification of unconjugated metanephrines in human plasma without interference by acetaminophen.	Clinical chemistry 20010601
Enzymatic synthesis of vanillin.	Journal of agricultural and food chemistry 20010601