CS-0877886
4,7-Dimethyl-2-oxo-2h-chromene-3-carbonitrile
Manufacturer: ChemScene
CAS Number: 56394-30-0
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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
C₁₂H₉NO₂
Molecular Weight
199.21
Synonyms
None
SMILES
CC1=CC2=C(C=C1)C(=C(C(=O)O2)C#N)C
Tpsa
54
Logp
2.28152
H Acceptors
3
H Donors
0
Rotatable Bonds
0
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: C₁₂H₉NO₂
Molecular Weight: 199.21
Synonyms: None
SMILES: CC1=CC2=C(C=C1)C(=C(C(=O)O2)C#N)C
Tpsa: 54
Logp: 2.28152
H Acceptors: 3
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₉NO₂
Molecular Weight:
199.21
Synonyms:
None
SMILES:
CC1=CC2=C(C=C1)C(=C(C(=O)O2)C#N)C
Tpsa:
54
Logp:
2.28152
H Acceptors:
3
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₂₃N₃O₇
Molecular Weight: 321.33
Synonyms: None
SMILES: C[C@H]([C@@H](C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)O)N)O
Tpsa: 182.21
Logp: -3.4897
H Acceptors: 7
H Donors: 7
Rotatable Bonds: 8
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₂₃N₃O₇
Molecular Weight:
321.33
Synonyms:
None
SMILES:
C[C@H]([C@@H](C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(=O)O)N)O
Tpsa:
182.21
Logp:
-3.4897
H Acceptors:
7
H Donors:
7
Rotatable Bonds:
8
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₆BrN
Molecular Weight: 160.01
Synonyms: None
SMILES: CN1C=CC=C1Br
Tpsa: 4.93
Logp: 1.7876
H Acceptors: 1
H Donors: 0
Rotatable Bonds: 0
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₆BrN
Molecular Weight:
160.01
Synonyms:
None
SMILES:
CN1C=CC=C1Br
Tpsa:
4.93
Logp:
1.7876
H Acceptors:
1
H Donors:
0
Rotatable Bonds:
0
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₁₁O₅P
Molecular Weight: 182.11
Synonyms: None
SMILES: C(CCP(=O)(O)O)CC(=O)O
Tpsa: 94.83
Logp: 0.419
H Acceptors: 2
H Donors: 3
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₁₁O₅P
Molecular Weight:
182.11
Synonyms:
None
SMILES:
C(CCP(=O)(O)O)CC(=O)O
Tpsa:
94.83
Logp:
0.419
H Acceptors:
2
H Donors:
3
Rotatable Bonds:
5