CS-0880582
β-Oxo-1H-benzimidazole-2-propanenitrile
Manufacturer: ChemScene
CAS Number: 790240-94-7
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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
C₁₀H₇N₃O
Molecular Weight
185.18
Synonyms
None
SMILES
N#CCC(C1=NC2=C(N1)C=CC=C2)=O
Tpsa
69.54
Logp
1.65928
H Acceptors
3
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: C₁₀H₇N₃O
Molecular Weight: 185.18
Synonyms: None
SMILES: N#CCC(C1=NC2=C(N1)C=CC=C2)=O
Tpsa: 69.54
Logp: 1.65928
H Acceptors: 3
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:
C₁₀H₇N₃O
Molecular Weight:
185.18
Synonyms:
None
SMILES:
N#CCC(C1=NC2=C(N1)C=CC=C2)=O
Tpsa:
69.54
Logp:
1.65928
H Acceptors:
3
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: C₁₃H₁₅N₃O₃
Molecular Weight: 261.28
Synonyms: None
SMILES: O=C(C1CNCCN12)N(OCC3=CC=CC=C3)C2=O
Tpsa: 61.88
Logp: 0.3542
H Acceptors: 4
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:
C₁₃H₁₅N₃O₃
Molecular Weight:
261.28
Synonyms:
None
SMILES:
O=C(C1CNCCN12)N(OCC3=CC=CC=C3)C2=O
Tpsa:
61.88
Logp:
0.3542
H Acceptors:
4
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: C₈H₁₆N₂O₂S
Molecular Weight: 204.29
Synonyms: None
SMILES: C=CS(=O)(NC[C@@H]1CNCCC1)=O
Tpsa: 58.2
Logp: 0.0489
H Acceptors: 3
H Donors: 2
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:
C₈H₁₆N₂O₂S
Molecular Weight:
204.29
Synonyms:
None
SMILES:
C=CS(=O)(NC[C@@H]1CNCCC1)=O
Tpsa:
58.2
Logp:
0.0489
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: -20°C, sealed storage, away from moisture
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₁₄INO₄S
Molecular Weight: 455.27
Synonyms: None
SMILES: O=C(C1=CC2=C(N(S(=O)(C3=CC=C(C)C=C3)=O)C=C2I)C=C1)OC
Tpsa: 65.37
Logp: 3.57792
H Acceptors: 5
H Donors: 0
Rotatable Bonds: 3
Purity:
98%
MDL No:
None
Storage:
-20°C, sealed storage, away from moisture
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₁₄INO₄S
Molecular Weight:
455.27
Synonyms:
None
SMILES:
O=C(C1=CC2=C(N(S(=O)(C3=CC=C(C)C=C3)=O)C=C2I)C=C1)OC
Tpsa:
65.37
Logp:
3.57792
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
3