2-Methyl-5-Nitroaniline 98%

CAT: 1507-1738E 00100Size: 100 mgDry Ice: NoHazardous: No

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CAT#:1507-1738E 00100Size:100 mg

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CAS Number

99-55-8

HSN Code

98020000

Chemical Information

2-Methyl-5-Nitroaniline

5-nitro-o-toluidine is a C-nitro compound in which the nitro compound is meta to the amino group and para to the methyl group of o-toluidine. It is functionally related to an o-toluidine.

CAS Number	99-55-8
PubChem CID	7444
IUPAC Name	2-methyl-5-nitroaniline
Molecular Formula	C7H8N2O2
Molecular Weight	152.15
XLogP	1.9
Topological Polar Surface Area	71.8
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Heavy Atom Count	11
Formal Charge	0
Complexity	155

SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])N

InChI

InChI=1S/C7H8N2O2/c1-5-2-3-6(9(10)11)4-7(5)8/h2-4H,8H2,1H3

InChIKey

DSBIJCMXAIKKKI-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 99-55-8

CID: 7444

Formula: C7H8N2O2

MW: 152.15

Interactive 3D Structure

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Computed Properties

Property	Value
Molecular Weight	152.15
XLogP3	1.9
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	0
Exact Mass	152.058577502
Monoisotopic Mass	152.058577502
Topological Polar Surface Area	71.8 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	155
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

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Alternative Products

Catalog	Name
418760-01	2-Methyl-5-nitroaniline
OR51790-01	5-Methyl-2-nitroaniline
OR322263	2-Methyl-5-nitroaniline hydrate
M22730-01	2-Methyl-5-Nitroaniline 98%
281559-01	3-Methyl-5-nitroaniline
JBA64899-01	4-Chloro-2-methyl-5-nitroaniline
VEA38142	5-Fluoro-N-methyl-2-nitroaniline
436367-01	5-Ethoxy-N-methyl-2-nitroaniline
436177-01	5-Chloro-4-methyl-2-nitroaniline
OR1062539-01	2-Methoxy-5-methyl-4-nitroaniline

2-Methyl-5-Nitroaniline 98%

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