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1-(2-Methyl-5-nitrophenyl)guanidine Nitrate

1-(2-Methyl-5-nitrophenyl)guanidine Nitrate - CAS 152460-08-7

Name: 1-(2-Methyl-5-nitrophenyl)guanidine Nitrate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB010787
Product Name:	1-(2-Methyl-5-nitrophenyl)guanidine Nitrate
CAS:	152460-08-7
Synonyms:	2-(2-methyl-5-nitrophenyl)guanidine;nitric acid; 2-(2-methyl-5-nitrophenyl)guanidine;nitric acid

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-(2-methyl-5-nitrophenyl)guanidine;nitric acid
Description:	Protein kinase inhibitors.
Molecular Weight:	257.20
Molecular Formula:	C8H11N5O5
Canonical SMILES:	CC1=C(C=C(C=C1)[N+](=O)[O-])N=C(N)N.[N+](=O)(O)[O-]
InChI:	InChI=1S/C8H10N4O2.HNO3/c1-5-2-3-6(12(13)14)4-7(5)11-8(9)10;2-1(3)4/h2-4H,1H3,(H4,9,10,11);(H,2,3,4)
InChI Key:	IINMQQJNRFDBMV-UHFFFAOYSA-N
Boiling Point:	426.7 °C at 760 mmHg
Melting Point:	218-221 °C
Purity:	> 95 %
Appearance:	Off-white solid
MDL:	MFCD23701564
LogP:	2.88890

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Related Functional Groups

Nitrogen Compounds

[1383427-98-2]C7H13ClN2O2
(S)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[865774-78-3]C16H21F2NO2
2-(6,8-difluoro-1,2,3,4-tetrahydro-naphthalen-2-ylamino)-pentanoic acid methyl ester
[916792-07-9]C8H5BrFN
2-Bromo-4-fluoro-5-methylbenzonitrile
[5724-76-5]C7H9NO4
3-(2,5-Dioxopyrrolidin-1-yl)propionic acid
[514801-07-1]C13H12ClN3O4
3-[(4-Chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)methyl]-4-methoxybenzaldehyde
[150517-77-4]C8H7F4N
3-Fluoro-5-(trifluoromethyl)benzylamine

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P264, P280, P302+P352, P305+P351+P338, P321, P332+P313, P337+P313, and P362
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-112827368-A	Anti-pollution reverse osmosis membrane and preparation method thereof	20210107
CN-111039921-A	Synthesis process of imatinib and imatinib mesylate	20191217
DE-102017004596-A1	Process for the preparation of phenylguanidines or their salts	20170513
EP-3621952-A1	Method for the production of phenylguanidines or the salts thereof	20170513
WO-2018210633-A1	Method for the production of phenylguanidines or the salts thereof	20170513

Complexity:	269
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	257.07601847
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	257.07601847
Rotatable Bond Count:	1
Topological Polar Surface Area:	176 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0