1-Methyl-3-nitroguanidine - ≥98%, ~25%water , CAS No.4245-76-5

CAS: 4245-76-5 Cat. No.: M102350 Molecular Weight: 118.09 EC Number: 610-029-6 PubChem CID: 20237
AVAILABLE TO ORDER
GRADE & PURITY ≥98% ~25%water
Synonyms
2-methyl-1-nitroguanidine | FT-0656957 | AKOS015995401 | N''-METHYL-N-NITROGUANIDINE | AKOS003397414 | J-504928 | MFCD00024167 | SCHEMBL422868 | 1-methyl-2-nitroguanidine | DTXSID70195230 | D87774 | Q17578672 | 1-Methyl-3-nitroguanidine | 1-Methyl-3-nitro
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
5g
M102350-5g
3
$12.90
25g
M102350-25g
3
$18.90
100g
M102350-100g
3
$42.90
250g
M102350-250g
2
$106.90
500g
M102350-500g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$183.90
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Why this grade

≥98%, ~25%water for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

1-Methyl-3-nitroguanidine (MNG) is formed as intermediate during the production of hydroxyl radical during 1-methyl-3-nitro-1-nitrosoguanidine (MNNG) - induced gastric cancer in the xanthine oxidase system. MNG has been referred by the U.S. Air Force Armament Laboratory for use in explosive formulations. MNG is formed during nucleophilic attack by H2O2 on the nitroso nitrogen of MNNG. MNG is non-carcinogenic analog of N-methyl-N′-nitro-N-nitrosoguanidine (direct-acting carcinogen).
1-Methyl-3-nitroguanidine (N-methyl-N′-nitroguanidine) was used in the synthesis of clothianidin hapten.

Specifications

Synonyms
2-methyl-1-nitroguanidine | FT-0656957 | AKOS015995401 | N''-METHYL-N-NITROGUANIDINE | AKOS003397414 | J-504928 | MFCD00024167 | SCHEMBL422868 | 1-methyl-2-nitroguanidine | DTXSID70195230 | D87774 | Q17578672 | 1-Methyl-3-nitroguanidine | 1-Methyl-3-nitro
Specifications & Purity
≥98%, ~25%water
Storage
Room temperature
Shipped In
Normal
Purity
≥98%
Names and Identifiers
Canonical SmilesCN=C(N)N[N+](=O)[O-]
IUPAC Name2-methyl-1-nitroguanidine
InChIKeyXCXKNNGWSDYMMS-UHFFFAOYSA-N
INCHI1S/C2H6N4O2/c1-4-2(3)5-6(7)8/h1H3,(H3,3,4,5)
Isomeric SMILES CN=C(N)N[N+](=O)[O-]
WGK Germany 3
RTECS MF4125000
PubChem CID 20237
UN Number 1325
Molecular Weight 118.09
Reaxy-Rn 5495905

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganic nitrogen compounds
ClassOrganonitrogen compounds
SubclassGuanidines
Intermediate Tree Nodes Not available
Direct ParentNitroguanidines
Alternative Parents Nitramines  Propargyl-type 1,3-dipolar organic compounds  Carboximidamides  Organopnictogen compounds  Organic zwitterions  Organic oxides  Imines  Hydrocarbon derivatives  
Molecular FrameworkAliphatic acyclic compounds
Substituents Nitroguanidine - Nitramine - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboximidamide - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Imine - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as nitroguanidines. These are organonitrogen compounds containing a nitro group, which is N-linked to a guanidine.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

8 results found

Lot NumberCertificate TypeDateItem
I2201572Certificate of AnalysisJun 11, 2026 M102350
I2201618Certificate of AnalysisJun 11, 2026 M102350
H1823143Certificate of AnalysisMar 20, 2026 M102350
H1823142Certificate of AnalysisMar 20, 2026 M102350
L2515252Certificate of AnalysisJun 24, 2024 M102350
L2515253Certificate of AnalysisJun 24, 2024 M102350
L2515264Certificate of AnalysisJun 24, 2024 M102350
H1527035Certificate of AnalysisApr 14, 2023 M102350
Chemical and Physical Properties
Flash Point(°C)89°C
Melt Point(°C)153-155°C
Molecular Weight118.100 g/mol
XLogP3-0.700
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass118.049 Da
Monoisotopic Mass118.049 Da
Topological Polar Surface Area96.200 Ų
Heavy Atom Count8
Formal Charge0
Complexity114.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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