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4-(METHYLNITROSAMINO)-1-(3-PYRIDYL)-1-BUTANOL

CAS No.
76014-81-8
Chemical Name:
4-(METHYLNITROSAMINO)-1-(3-PYRIDYL)-1-BUTANOL
Synonyms
NNAL;rac NNAL;α-[3-(MethylnitrosoaMino)propyl]-;4-(METHYLNITROSAMINO)-1-(3-PYRIDYL)-BUTAN-1-OL;4-(methylnitrosoamino)-1--(3-pyridyl)-1-butanol;4-(MethylnitrosaMino)-1-(3-pyridyl)-1-butanol-d5;4-(N-Methyl-N-nitrosamino)-1-(3-pyridyl)butan-1-ol;a-[3-(Methylnitrosoamino)propyl]-3-pyridinemethanol;3-Pyridinemethanol, α-[3-(methylnitrosoamino)propyl]-;alpha-(3-(methylnitrosoamino)propyl)-3-pyridinemethano
CBNumber:
CB4501459
Molecular Formula:
C10H15N3O2
Molecular Weight:
209.24
MDL Number:
MFCD00870462
MOL File:
76014-81-8.mol
Last updated:2023-05-04 17:34:42

4-(METHYLNITROSAMINO)-1-(3-PYRIDYL)-1-BUTANOL Properties

Boiling point 348.61°C (rough estimate)
Density 1.1599 (rough estimate)
refractive index 1.4830 (estimate)
Flash point 9℃
storage temp. 2-8°C
solubility Chloroform (Slightly), Methanol (Slightly)
pka 13.54±0.20(Predicted)
color Pale Yellow to Yellow
FDA UNII EN7PIX794W

SAFETY

Risk and Safety Statements

Symbol(GHS)  GHS hazard pictogramsGHS hazard pictogramsGHS hazard pictograms
GHS02,GHS06,GHS08
Signal word  Danger
Hazard statements  H225-H301+H311+H331-H370
Precautionary statements  P210-P260-P280-P301+P310-P311
Hazard Codes  F,T
Risk Statements  11-23/24/25-39/23/24/25
Safety Statements  7-16-36/37-45
RIDADR  UN1230 - class 3 - PG 2 - Methanol, solution
WGK Germany  3
RTECS  UT5014750

4-(METHYLNITROSAMINO)-1-(3-PYRIDYL)-1-BUTANOL price More Price(9)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Sigma-Aldrich 59773 4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol analytical standard 76014-81-8 10mg $488 2024-03-01 Buy
TRC M325740 4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol 76014-81-8 10mg $90 2021-12-16 Buy
TRC M325740 4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol 76014-81-8 25mg $145 2021-12-16 Buy
TRC M325740 4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol 76014-81-8 50mg $260 2021-12-16 Buy
Medical Isotopes, Inc. 65764 4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol(1.0mg/mLinMethanol) 76014-81-8 1mL $610 2021-12-16 Buy
Product number Packaging Price Buy
59773 10mg $488 Buy
M325740 10mg $90 Buy
M325740 25mg $145 Buy
M325740 50mg $260 Buy
65764 1mL $610 Buy

4-(METHYLNITROSAMINO)-1-(3-PYRIDYL)-1-BUTANOL Chemical Properties,Uses,Production

Chemical Properties

Oil

Uses

A metabolite of NNK (Cat. #M325750), a tobacco-specific nitrosamine.

Definition

ChEBI: 4-(methylnitrosamino)-1-(3-pyridyl)-1-butanol is a member of the class of nitrosamines that is butan-1-ol substituted by a pyridin-3-yl group at position 1 and by a methyl(nitroso)amino group at position 4. It is a major metabolite of nitrosamine 4-(methylnitrosamino)-1-(3-pyridyl)-1-butanone (NNK), which is a carcinogen found in tobacco and responsible for inducing lung cancer in smokers. It has a role as a biomarker, a human urinary metabolite and a carcinogenic agent. It is a member of pyridines, a nitrosamine and a secondary alcohol. It is functionally related to a 4-(N-nitrosomethylamino)-1-(3-pyridyl)butan-1-one.

General Description

This certified Snap-N-Spike? solution is suitable for use as starting material in calibrators and controls for nicotine testing, environmental monitoring, or clinical and diagnostic testing of nicotine biomarkers by LC-MS/MS or GC/MS. NNAL is a metabolite of NNK or 4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanone. Measurement of NNAL levels in urine is a reliable way to determine NNK exposure in smokers, non-smokers exposed to environmental tobacco smoke (ETS), or users of smokeless tobacco products such as chewing tobacco or snuff.

4-(METHYLNITROSAMINO)-1-(3-PYRIDYL)-1-BUTANOL Preparation Products And Raw materials

Raw materials

Preparation Products

4-(METHYLNITROSAMINO)-1-(3-PYRIDYL)-1-BUTANOL Suppliers

Global( 17)Suppliers
Supplier Tel Email Country ProdList Advantage
J & K SCIENTIFIC LTD. 010-82848833 400-666-7788 jkinfo@jkchemical.com China 94838 76
Chemsky(shanghai)International Co.,Ltd. 021-50135380 shchemsky@sina.com China 32344 50
Sigma-Aldrich 021-61415566 800-8193336 orderCN@merckgroup.com China 51471 80
Shanghai Jizhi Biochemical Technology Co. Ltd. 400-400-400-9004166 18616739031 3007523370@qq.com China 52712 58
Shenzhen Polymeri Biochemical Technology Co., Ltd. +86-400-002-6226 13028896684 sales@rrkchem.com China 55791 58
Energy Chemical 021-58432009 400-005-6266 marketing@energy-chemical.com China 44941 58
TCI (Shanghai) Chemical Trading Co., Ltd. 021-61109150 sales@tcisct.com China 31183 58
LGC Science (Shanghai) Ltd. 17717235263 cindy.yang@lgcgroup.com China 11437 58
Shanghai isotope chemical co.,ltd 021-021-51600108 13062666369 sales@chinaisotope.com China 4272 58
4-(methylnitrosoamino)-1--(3-pyridyl)-1-butanol alpha-(3-(methylnitrosoamino)propyl)-3-pyridinemethano NNAL 4-(METHYLNITROSAMINO)-1-(3-PYRIDYL)-BUTAN-1-OL 4-(N-Methyl-N-nitrosamino)-1-(3-pyridyl)butan-1-ol a-[3-(Methylnitrosoamino)propyl]-3-pyridinemethanol rac NNAL α-[3-(MethylnitrosoaMino)propyl]- 4-(MethylnitrosaMino)-1-(3-pyridyl)-1-butanol-d5 4-(MethylnitrosaMino)-1-(3-pyridyl)-1-butanol (1.0 Mg/ML in Methanol) 4-(Methylnitrosamino)-1-(3-pyridyl)-1-butanol solution 3-Pyridinemethanol, α-[3-(methylnitrosoamino)propyl]- 76014-81-8 Heterocycles Metabolites & Impurities Nicotine Derivatives