CS-0628454
2-(3-Bromo-1-(2-hydroxyethyl)-1H-pyrazol-5-yl)acetonitrile
Manufacturer: ChemScene
CAS Number: 2770250-92-3
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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
C₇H₈BrN₃O
Molecular Weight
230.06
Synonyms
None
SMILES
N#CCC1=CC(Br)=NN1CCO
Tpsa
61.84
Logp
0.70398
H Acceptors
4
H Donors
1
Rotatable Bonds
3
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: C₇H₈BrN₃O
Molecular Weight: 230.06
Synonyms: None
SMILES: N#CCC1=CC(Br)=NN1CCO
Tpsa: 61.84
Logp: 0.70398
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:
C₇H₈BrN₃O
Molecular Weight:
230.06
Synonyms:
None
SMILES:
N#CCC1=CC(Br)=NN1CCO
Tpsa:
61.84
Logp:
0.70398
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: C₁₁H₁₅NO₄S
Molecular Weight: 257.31
Synonyms: None
SMILES: O=S(C1=CC=C(C)C=C1)(N[C@@H]2COC[C@H]2O)=O
Tpsa: 75.63
Logp: 0.03302
H Acceptors: 4
H Donors: 2
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:
C₁₁H₁₅NO₄S
Molecular Weight:
257.31
Synonyms:
None
SMILES:
O=S(C1=CC=C(C)C=C1)(N[C@@H]2COC[C@H]2O)=O
Tpsa:
75.63
Logp:
0.03302
H Acceptors:
4
H Donors:
2
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: C₁₁H₁₀O₅
Molecular Weight: 222.19
Synonyms: None
SMILES: O=C(C1=CC2=C(CC(O)C2)C=C1C(O)=O)O
Tpsa: 94.83
Logp: 0.5425
H Acceptors: 3
H Donors: 3
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:
C₁₁H₁₀O₅
Molecular Weight:
222.19
Synonyms:
None
SMILES:
O=C(C1=CC2=C(CC(O)C2)C=C1C(O)=O)O
Tpsa:
94.83
Logp:
0.5425
H Acceptors:
3
H Donors:
3
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: C₁₁H₈BrNO₄
Molecular Weight: 298.09
Synonyms: None
SMILES: O=C(C1=CC(C#N)=C(Br)C=C1C(OC)=O)OC
Tpsa: 76.39
Logp: 1.89398
H Acceptors: 5
H Donors: 0
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:
C₁₁H₈BrNO₄
Molecular Weight:
298.09
Synonyms:
None
SMILES:
O=C(C1=CC(C#N)=C(Br)C=C1C(OC)=O)OC
Tpsa:
76.39
Logp:
1.89398
H Acceptors:
5
H Donors:
0
Rotatable Bonds:
2