CS-0613246
Methyl 3-iodo-3a,7a-dihydro-1H-indazole-5-carboxylate
Manufacturer: ChemScene
CAS Number: 2505462-76-8
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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
C₉H₉IN₂O₂
Molecular Weight
304.08
Synonyms
None
SMILES
COC(C1=CC2C(C=C1)NN=C2I)=O
Tpsa
50.69
Logp
0.9921
H Acceptors
4
H Donors
1
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: C₉H₉IN₂O₂
Molecular Weight: 304.08
Synonyms: None
SMILES: COC(C1=CC2C(C=C1)NN=C2I)=O
Tpsa: 50.69
Logp: 0.9921
H Acceptors: 4
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:
C₉H₉IN₂O₂
Molecular Weight:
304.08
Synonyms:
None
SMILES:
COC(C1=CC2C(C=C1)NN=C2I)=O
Tpsa:
50.69
Logp:
0.9921
H Acceptors:
4
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: C₁₂H₁₈BNO₃
Molecular Weight: 235.09
Synonyms: None
SMILES: CC1=C(C=CNC1=O)B2OC(C)(C(C)(O2)C)C
Tpsa: 51.32
Logp: 0.98252
H Acceptors: 3
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:
C₁₂H₁₈BNO₃
Molecular Weight:
235.09
Synonyms:
None
SMILES:
CC1=C(C=CNC1=O)B2OC(C)(C(C)(O2)C)C
Tpsa:
51.32
Logp:
0.98252
H Acceptors:
3
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: C₁₄H₈BrClFNO
Molecular Weight: 340.57
Synonyms: None
SMILES: O=C1N(C2=CC=C(Cl)C=C2F)CC3=C1C=CC=C3Br
Tpsa: 20.31
Logp: 4.402
H Acceptors: 1
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:
C₁₄H₈BrClFNO
Molecular Weight:
340.57
Synonyms:
None
SMILES:
O=C1N(C2=CC=C(Cl)C=C2F)CC3=C1C=CC=C3Br
Tpsa:
20.31
Logp:
4.402
H Acceptors:
1
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: C₁₁H₁₆BrN₃O₄
Molecular Weight: 334.17
Synonyms: None
SMILES: O=C(C1=CC(Br)=NN1CCNC(OC(C)(C)C)=O)O
Tpsa: 93.45
Logp: 1.8685
H Acceptors: 5
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:
C₁₁H₁₆BrN₃O₄
Molecular Weight:
334.17
Synonyms:
None
SMILES:
O=C(C1=CC(Br)=NN1CCNC(OC(C)(C)C)=O)O
Tpsa:
93.45
Logp:
1.8685
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
4