CS-1136837
N-(3,6-Difluoro-5-iodo-2-pyridinyl) imidodicarbonic acid C,C'-bis(1,1-dimethylethyl) ester
Manufacturer: ChemScene
CAS Number: 3041032-39-4
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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
C₁₅H₁₉F₂IN₂O₄
Molecular Weight
456.22
Synonyms
None
SMILES
O=C(OC(C)(C)C)N(C1=NC(F)=C(I)C=C1F)C(OC(C)(C)C)=O
Tpsa
68.73
Logp
4.641
H Acceptors
5
H Donors
0
Rotatable Bonds
1
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: C₁₅H₁₉F₂IN₂O₄
Molecular Weight: 456.22
Synonyms: None
SMILES: O=C(OC(C)(C)C)N(C1=NC(F)=C(I)C=C1F)C(OC(C)(C)C)=O
Tpsa: 68.73
Logp: 4.641
H Acceptors: 5
H Donors: 0
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:
C₁₅H₁₉F₂IN₂O₄
Molecular Weight:
456.22
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N(C1=NC(F)=C(I)C=C1F)C(OC(C)(C)C)=O
Tpsa:
68.73
Logp:
4.641
H Acceptors:
5
H Donors:
0
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: C₁₀H₁₆BNO₃
Molecular Weight: 209.05
Synonyms: None
SMILES: OB(C1=CN=C(CC(C)(C)O)C=C1C)O
Tpsa: 73.58
Logp: -0.61678
H Acceptors: 4
H Donors: 3
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:
C₁₀H₁₆BNO₃
Molecular Weight:
209.05
Synonyms:
None
SMILES:
OB(C1=CN=C(CC(C)(C)O)C=C1C)O
Tpsa:
73.58
Logp:
-0.61678
H Acceptors:
4
H Donors:
3
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: C₆H₁₂FN
Molecular Weight: 117.16
Synonyms: None
SMILES: CC1(C)NCC(F)C1
Tpsa: 12.03
Logp: 1.0964
H Acceptors: 1
H Donors: 1
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:
C₆H₁₂FN
Molecular Weight:
117.16
Synonyms:
None
SMILES:
CC1(C)NCC(F)C1
Tpsa:
12.03
Logp:
1.0964
H Acceptors:
1
H Donors:
1
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: C₃₄H₄₄Ar₄P₂
Molecular Weight: 674.45
Synonyms: None
SMILES: [P]C1=C2C(CC[C@]23CCC4=C3C([P])=CC=C4)=CC=C1.CC5=CC(C(C)(C)C)=CC(C(C)(C)C)=C5.CC.[Ar].[Ar].[Ar].[Ar]
Tpsa: 0
Logp: 9.55292
H Acceptors: 0
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:
C₃₄H₄₄Ar₄P₂
Molecular Weight:
674.45
Synonyms:
None
SMILES:
[P]C1=C2C(CC[C@]23CCC4=C3C([P])=CC=C4)=CC=C1.CC5=CC(C(C)(C)C)=CC(C(C)(C)C)=C5.CC.[Ar].[Ar].[Ar].[Ar]
Tpsa:
0
Logp:
9.55292
H Acceptors:
0
H Donors:
0
Rotatable Bonds:
0