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Product No: AA6134

1-Methylpiperazine, 98%

Name: 1-Methylpiperazine
Brand: Chempure

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CAS Number

109-01-3

Molecular Weight

100.16

Formula

C5H12N2

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About this item

IUPAC name	1-methylpiperazine
canonical smiles	CN1CCNCC1
inchi	InChI=1S/C5H12N2/c1-7-4-2-6-3-5-7/h6H,2-5H2,1H3
inchi key	PVOAHINGSUIXLS-UHFFFAOYSA-N
molecular formula	C5H12N2
synonyms	1-Methylpiperazine N-Methylpiperazine 109-01-3 4-Methylpiperazine n-methyl piperazine
Compound Description	1-Methylpiperazine is a N-methylpiperazine.

Computed Properties

Molecular Weight:	100.16 g/mol
XLogP3:	-0.4
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	0
Exact Mass:	100.100048391 g/mol
Monoisotopic Mass:	100.100048391 g/mol
Topological Polar Surface Area:	15.3 Å²
Heavy Atom Count:	7
Formal Charge:	0
Complexity:	48
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

Related Compounds

Piperazine

Piperidine

Morpholine

1,4-Diazabicyclo[2.2.2]octane

2-Methylpiperidine

Thiazolidine

Hexamethyleneimine

1-(2-Aminoethyl)piperazine

4-Hydroxypyridine

N-(2-Hydroxyethyl)piperazine

1-Methylpiperazine

Thialdine

1-Nitrosopiperazine

1,4-Dimethylpiperazine

3-Methylpiperidine

hazard signal	Danger
hazard classes and categories	Flam. Liq. 3 (99.72%) Acute Tox. 4 (47.46%) Skin Corr. 1B (100%) Skin Sens. 1B (52.26%) Eye Dam. 1 (50%) Acute Tox. 1 (25.99%) Acute Tox. 3 (12.99%) Acute Tox. 4 (55.37%) Corrosives, Flammable - 2nd degree
precautionary statement codes	P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P271, P272, P280, P284, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P320, P321, P333+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501
hazard statements	H226 (99.72%): Flammable liquid and vapor [Warning Flammable liquids] H312 (47.46%): Harmful in contact with skin [Warning Acute toxicity, dermal] H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] H317 (52.26%): May cause an allergic skin reaction [Warning Sensitization, Skin] H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H330 (25.99%): Fatal if inhaled [Danger Acute toxicity, inhalation] H331 (12.99%): Toxic if inhaled [Danger Acute toxicity, inhalation] H332 (55.37%): Harmful if inhaled [Warning Acute toxicity, inhalation]
hazards summary	Causes skin corrosion in acute dermal studies of rabbits. Causes convulsions in acute inhalation studies of mice. Causes multiple liver effects, changes in renal tubules, changes in recording from peripheral motor nerve, and general anesthesia in acute oral studies of mice. Causes burns. May cause skin sensitization. Harmful by inhalation. Causes burns. Inhalation may cause corrosive injuries to upper respiratory tract and lungs. Harmful by skin absorption. Toxic by inhalation. See Piperazine and salts.

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Documentation

Certificate of Analysis

Lot Number

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CAS #

*This document is like a lab demo—an example Certificate of Analysis (COA) that showcases what a COA looks like but may not match the latest batch in all its glory. Think of it as a chemistry experiment: close, but not quite the final reaction!

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About this item

IUPAC name	1-methylpiperazine
canonical smiles	CN1CCNCC1
inchi	InChI=1S/C5H12N2/c1-7-4-2-6-3-5-7/h6H,2-5H2,1H3
inchi key	PVOAHINGSUIXLS-UHFFFAOYSA-N
molecular formula	C5H12N2
synonyms	1-Methylpiperazine N-Methylpiperazine 109-01-3 4-Methylpiperazine n-methyl piperazine
Compound Description	1-Methylpiperazine is a N-methylpiperazine.

Computed Properties

Molecular Weight:	100.16 g/mol
XLogP3:	-0.4
Hydrogen Bond Donor Count:	1
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	0
Exact Mass:	100.100048391 g/mol
Monoisotopic Mass:	100.100048391 g/mol
Topological Polar Surface Area:	15.3 Å²
Heavy Atom Count:	7
Formal Charge:	0
Complexity:	48
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

Related Compounds

Piperazine

Piperidine

Morpholine

1,4-Diazabicyclo[2.2.2]octane

2-Methylpiperidine

Thiazolidine

Hexamethyleneimine

1-(2-Aminoethyl)piperazine

4-Hydroxypyridine

N-(2-Hydroxyethyl)piperazine

1-Methylpiperazine

Thialdine

1-Nitrosopiperazine

1,4-Dimethylpiperazine

3-Methylpiperidine

hazard signal	Danger
hazard classes and categories	Flam. Liq. 3 (99.72%) Acute Tox. 4 (47.46%) Skin Corr. 1B (100%) Skin Sens. 1B (52.26%) Eye Dam. 1 (50%) Acute Tox. 1 (25.99%) Acute Tox. 3 (12.99%) Acute Tox. 4 (55.37%) Corrosives, Flammable - 2nd degree
precautionary statement codes	P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P271, P272, P280, P284, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P320, P321, P333+P317, P362+P364, P363, P370+P378, P403+P233, P403+P235, P405, and P501
hazard statements	H226 (99.72%): Flammable liquid and vapor [Warning Flammable liquids] H312 (47.46%): Harmful in contact with skin [Warning Acute toxicity, dermal] H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] H317 (52.26%): May cause an allergic skin reaction [Warning Sensitization, Skin] H318 (50%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H330 (25.99%): Fatal if inhaled [Danger Acute toxicity, inhalation] H331 (12.99%): Toxic if inhaled [Danger Acute toxicity, inhalation] H332 (55.37%): Harmful if inhaled [Warning Acute toxicity, inhalation]
hazards summary	Causes skin corrosion in acute dermal studies of rabbits. Causes convulsions in acute inhalation studies of mice. Causes multiple liver effects, changes in renal tubules, changes in recording from peripheral motor nerve, and general anesthesia in acute oral studies of mice. Causes burns. May cause skin sensitization. Harmful by inhalation. Causes burns. Inhalation may cause corrosive injuries to upper respiratory tract and lungs. Harmful by skin absorption. Toxic by inhalation. See Piperazine and salts.

Product No: AA6134

1-Methylpiperazine, 98%

Product No: AA6134

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

About this item

Documentation

Certificate of Analysis

Require a Sample Certificate of Analysis (COA) ?

Reviews

Product No: AA6134

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?