CS-0577204
3-Amino-2-benzyl-7-nitro-1-oxo-1,2-dihydroisoquinoline-4-carbonitrile
Manufacturer: ChemScene
CAS Number: 130651-66-0
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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
C₁₇H₁₂N₄O₃
Molecular Weight
320.30
Synonyms
3-amino-2-benzyl-7-nitro-1-oxoisoquinoline-4-carbonitrile
SMILES
C1=CC=C(C=C1)CN2C(=C(C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])C#N)N
Tpsa
114.95
Logp
2.41188
H Acceptors
6
H Donors
1
Rotatable Bonds
3
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 130651-66-0 | 3-amino-2-benzyl-7-nitro-1-oxo-1,2-dihydroisoquinoline-4-carbonitrile | A2B Chem | -- |
SAFETY INFORMATION
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
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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: C₁₇H₁₂N₄O₃
Molecular Weight: 320.30
Synonyms: 3-amino-2-benzyl-7-nitro-1-oxoisoquinoline-4-carbonitrile
SMILES: C1=CC=C(C=C1)CN2C(=C(C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])C#N)N
Tpsa: 114.95
Logp: 2.41188
H Acceptors: 6
H Donors: 1
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:
C₁₇H₁₂N₄O₃
Molecular Weight:
320.30
Synonyms:
3-amino-2-benzyl-7-nitro-1-oxoisoquinoline-4-carbonitrile
SMILES:
C1=CC=C(C=C1)CN2C(=C(C3=C(C2=O)C=C(C=C3)[N+](=O)[O-])C#N)N
Tpsa:
114.95
Logp:
2.41188
H Acceptors:
6
H Donors:
1
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: C₁₁H₁₆N₂O₃
Molecular Weight: 224.26
Synonyms: N-(2-HYDROXYETHYL)-3-(4-NITROPHENYL) PROPYLAMINE C11H16N2O3
SMILES: C1=CC(=CC=C1CCCNCCO)[N+](=O)[O-]
Tpsa: 75.4
Logp: 1.1093
H Acceptors: 4
H Donors: 2
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₁H₁₆N₂O₃
Molecular Weight:
224.26
Synonyms:
N-(2-HYDROXYETHYL)-3-(4-NITROPHENYL) PROPYLAMINE C11H16N2O3
SMILES:
C1=CC(=CC=C1CCCNCCO)[N+](=O)[O-]
Tpsa:
75.4
Logp:
1.1093
H Acceptors:
4
H Donors:
2
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₂₂N₂O
Molecular Weight: 234.34
Synonyms: 1-[2-(4-methoxyphenyl)ethyl]piperidin-3-amine
SMILES: COC1=CC=C(C=C1)CCN2CCCC(C2)N
Tpsa: 38.49
Logp: 1.6608
H Acceptors: 3
H Donors: 1
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:
C₁₄H₂₂N₂O
Molecular Weight:
234.34
Synonyms:
1-[2-(4-methoxyphenyl)ethyl]piperidin-3-amine
SMILES:
COC1=CC=C(C=C1)CCN2CCCC(C2)N
Tpsa:
38.49
Logp:
1.6608
H Acceptors:
3
H Donors:
1
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: C₁₃H₁₄N₂O₂
Molecular Weight: 230.26
Synonyms: None
SMILES: N#CC1=CC=C(OCCCCC#N)C(OC)=C1
Tpsa: 66.04
Logp: 2.63956
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₃H₁₄N₂O₂
Molecular Weight:
230.26
Synonyms:
None
SMILES:
N#CC1=CC=C(OCCCCC#N)C(OC)=C1
Tpsa:
66.04
Logp:
2.63956
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
6