3-Methylbenzylamine - CAS 100-81-2

Catalog:	BB000344
Product Name:	3-Methylbenzylamine
CAS:	100-81-2
Synonyms:	(3-methylphenyl)methanamine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	(3-methylphenyl)methanamine
Description:	3-Methylbenzylamine (CAS# 100-81-2) is a useful research chemical.
Molecular Weight:	121.18
Molecular Formula:	C8H11N
Canonical SMILES:	CC1=CC(=CC=C1)CN
InChI:	InChI=1S/C8H11N/c1-7-3-2-4-8(5-7)6-9/h2-5H,6,9H2,1H3
InChI Key:	RGXUCUWVGKLACF-UHFFFAOYSA-N
Boiling Point:	202-205 °C
Purity:	97 %
Density:	0.966 g/cm³
Appearance:	Colorless to light yellow liqui
Storage:	Keep away from sources of ignition. Store in a cool, dry place. Store in a tightly closed container.
MDL:	MFCD00008118
LogP:	2.15400

Publication Number	Title	Priority Date
CN-113461674-A	Amide compound for promoting plant root growth and preparation method and application thereof	20210809
CN-113461543-A	Rectification purification method of 1, 3-cyclohexyldimethylamine crude product	20210727
CN-112625039-A	Pyrroloquinoline compound and synthesis method thereof	20210116
CN-112851521-A	Method for preparing primary amine by catalytic reduction of nitrile compound with nano porous palladium catalyst	20201230
CN-112624930-A	Preparation method of 2, 2-bis (4-aminophenyl) hexafluoropropane	20201221

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Related Functional Groups

Amines and Anilines

[556-90-1]
Pseudothiohydantoin
[1106917-71-8]
[3-(Difluoromethoxy)phenyl]methanamine hydrochloride
[6397-33-7]
2-(Isopropylthio)aniline
[328270-02-6]
2-Amino-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
[105512-81-0]
2-Amino-4-(3-bromophenyl)thiazole
[401940-05-4]
3-(2,6-Difluorophenyl)-1-propylamine

Nitrogen Compounds

[1427004-19-0]
DBCO-PEG4-NHS ester
[1383427-98-2]
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[333311-69-6]
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[62838-59-9]
1-Cyclopentyl-1H-pyrazole
[1281984-38-0]
1-Cyclopentyl-3,5-dinitro-1H-pyrazole
[55877-31-1]
1-Benzofuran-3-carbonitrile

GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Complexity:	80.6
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	121.089149355
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	121.089149355
Rotatable Bond Count:	1
Topological Polar Surface Area:	26 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3