Cas no 36-37-3 (3-nitrotoluene)
3-nitrotoluene structure
Product Name:3-nitrotoluene
3-nitrotoluene Chemical and Physical Properties
Names and Identifiers
-
- 3-nitrotoluene
- 3-Nitrotoluol
- Nitrotoluene, m-
- MNT
- m-nitro toluene
- SCHEMBL19334362
- Method 8330 Calibration Standard Solution B; 3-Nitrotoluene
- m-Methylnitrobenzene
- AKOS000121051
- Tox21_300007
- Nitrotoluene, m-isomer
- NSC9578
- SCHEMBL92055
- DTXSID90210136
- HMS3039H14
- Z104508722
- MLS001055494
- m-Nitrotoluene, liquid or solid [UN1664] [Poison]
- W-100052
- NCGC00090732-01
- Tox21_202435
- 3-NITROTOLUENE [HSDB]
- m-Nitrotoluene
- SCHEMBL10731554
- Q2816005
- 99-08-1
- 3-Nitrobenzyl radical
- DTXSID5021831
- CAS-99-08-1
- BDBM50008563
- WLN: WNR C1
- 3-Nitrotoluene, analytical standard
- m-Nitrotoluene, liquid or solid
- M-NITROTOLUENE [MI]
- F21441
- NCGC00090732-03
- N0274
- InChI=1/C7H7NO2/c1-6-3-2-4-7(5-6)8(9)10/h2-5H,1H
- 36-37-3
- NCGC00254182-01
- NSC-9578
- STL283957
- 3-Methyl-1-nitrobenzene
- Guaranteed Reagent,99.0%
- 3NT
- NSC 9578
- M-MONONITROTOLUENE
- MFCD00007265
- CCRIS 2312
- NCGC00259984-01
- UNII-29A9W826KQ
- SMR000677943
- C19486
- 1-methyl-3-nitro-benzene
- NCGC00090732-02
- 3-Nitrotoluene, 99%
- NCGC00090732-04
- EINECS 202-728-6
- CHEMBL114059
- m-Nitrotoluol
- F0001-2330
- 3-Methylnitrobenzene
- EN300-21681
- UN 1664
- Toluene, m-nitro-
- 1-Methyl-3-nitrobenzene
- NS00002108
- A845960
- meta-Nitrotoluol
- Benzene, 1-methyl-3-nitro-
- BS-43801
- CHEBI:39931
- HSDB 2937
- 29A9W826KQ
- EC 202-728-6
- DTXCID001831
-
- Inchi： 1S/C7H7NO2/c1-6-3-2-4-7(5-6)8(9)10/h2-5H,1H3
- InChI Key： QZYHIOPPLUPUJF-UHFFFAOYSA-N
- SMILES： [O-][N+](C1=CC=CC(C)=C1)=O
Computed Properties
- Exact Mass: 137.047678466g/mol
- Monoisotopic Mass: 137.047678466g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 130
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.4
- Topological Polar Surface Area: 45.8?2
Experimental Properties
- Ionization Potential: 9.48 eV
- Density: 4.73 (NTP, 1992) (Relative to Air)
- Melting Point: 59.9 °F (NTP, 1992)
- Boiling Point: 450.7 °F at 760 mm Hg (NTP, 1992)
- Flash Point: 223 °F (NTP, 1992)
- Refractive Index: Index of refraction: 1.5466 at 10 °C
- LogP: log Kow = 2.45
3-nitrotoluene Related Literature
-
Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
-
Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
-
Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
36-37-3 (3-nitrotoluene) Related Products
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