CS-0769157
2-Amino-4-Methyl-3,5-dinitrobenzonitrile
Manufacturer: ChemScene
CAS Number: 745048-51-5
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₈H₆N₄O₄
Molecular Weight
222.16
Synonyms
None
SMILES
CC1=C(C(N)=C(C=C1[N+]([O-])=O)C#N)[N+]([O-])=O
Tpsa
136.09
Logp
1.2653
H Acceptors
6
H Donors
1
Rotatable Bonds
2
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₈H₆N₄O₄
Molecular Weight: 222.16
Synonyms: None
SMILES: CC1=C(C(N)=C(C=C1[N+]([O-])=O)C#N)[N+]([O-])=O
Tpsa: 136.09
Logp: 1.2653
H Acceptors: 6
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₈H₆N₄O₄
Molecular Weight:
222.16
Synonyms:
None
SMILES:
CC1=C(C(N)=C(C=C1[N+]([O-])=O)C#N)[N+]([O-])=O
Tpsa:
136.09
Logp:
1.2653
H Acceptors:
6
H Donors:
1
Rotatable Bonds:
2
Purity: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₉H₁₀N₄O₄
Molecular Weight: 238.20
Synonyms: None
SMILES: CN1C(=NC2=C1C(=O)N(C)C(=O)N2C)C(O)=O
Tpsa: 99.12
Logp: -1.3311
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 1
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₉H₁₀N₄O₄
Molecular Weight:
238.20
Synonyms:
None
SMILES:
CN1C(=NC2=C1C(=O)N(C)C(=O)N2C)C(O)=O
Tpsa:
99.12
Logp:
-1.3311
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
1
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₇N₃O₆S
Molecular Weight: 297.24
Synonyms: None
SMILES: CCOC(=O)C1=NC2=CC(=CC(=C2S1)[N+]([O-])=O)[N+]([O-])=O
Tpsa: 125.47
Logp: 2.2894
H Acceptors: 8
H Donors: 0
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₇N₃O₆S
Molecular Weight:
297.24
Synonyms:
None
SMILES:
CCOC(=O)C1=NC2=CC(=CC(=C2S1)[N+]([O-])=O)[N+]([O-])=O
Tpsa:
125.47
Logp:
2.2894
H Acceptors:
8
H Donors:
0
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₁H₁₃N₃O₅
Molecular Weight: 267.24
Synonyms: None
SMILES: CC1=C(N2CCOCC2)C(=CC(=C1)[N+]([O-])=O)[N+]([O-])=O
Tpsa: 98.75
Logp: 1.64802
H Acceptors: 6
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₃N₃O₅
Molecular Weight:
267.24
Synonyms:
None
SMILES:
CC1=C(N2CCOCC2)C(=CC(=C1)[N+]([O-])=O)[N+]([O-])=O
Tpsa:
98.75
Logp:
1.64802
H Acceptors:
6
H Donors:
0
Rotatable Bonds:
3