CS-0529763
4-Chloro-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-2(3H)-one
Manufacturer: ChemScene
CAS Number: 1896464-15-5
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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
C₇H₈ClN₃O
Molecular Weight
185.61
Synonyms
None
SMILES
O=C1N=C(CNCC2)C2=C(Cl)N1
Tpsa
57.78
Logp
0.069
H Acceptors
3
H Donors
2
Rotatable Bonds
0
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SAFETY INFORMATION
Pictograms
Signal Word
Danger
UN Number
2811
Class
6.1
Packing Group
Ⅲ
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P361-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: C₇H₈ClN₃O
Molecular Weight: 185.61
Synonyms: None
SMILES: O=C1N=C(CNCC2)C2=C(Cl)N1
Tpsa: 57.78
Logp: 0.069
H Acceptors: 3
H Donors: 2
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:
C₇H₈ClN₃O
Molecular Weight:
185.61
Synonyms:
None
SMILES:
O=C1N=C(CNCC2)C2=C(Cl)N1
Tpsa:
57.78
Logp:
0.069
H Acceptors:
3
H Donors:
2
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: C₈H₄BrN₃
Molecular Weight: 222.04
Synonyms: None
SMILES: N#CC1=CC=C2C(NC(Br)=C2)=N1
Tpsa: 52.47
Logp: 2.19708
H Acceptors: 2
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:
C₈H₄BrN₃
Molecular Weight:
222.04
Synonyms:
None
SMILES:
N#CC1=CC=C2C(NC(Br)=C2)=N1
Tpsa:
52.47
Logp:
2.19708
H Acceptors:
2
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: C₄H₁₀O₃S
Molecular Weight: 138.19
Synonyms: tert-butyl sulfonic acid
SMILES: CC(S(=O)(O)=O)(C)C
Tpsa: 54.37
Logp: 0.6727
H Acceptors: 2
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:
C₄H₁₀O₃S
Molecular Weight:
138.19
Synonyms:
tert-butyl sulfonic acid
SMILES:
CC(S(=O)(O)=O)(C)C
Tpsa:
54.37
Logp:
0.6727
H Acceptors:
2
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: C₄H₁₂ClNO₂
Molecular Weight: 141.60
Synonyms: None
SMILES: NCC[C@@H](O)CO.Cl
Tpsa: 66.48
Logp: -0.8898
H Acceptors: 3
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:
C₄H₁₂ClNO₂
Molecular Weight:
141.60
Synonyms:
None
SMILES:
NCC[C@@H](O)CO.Cl
Tpsa:
66.48
Logp:
-0.8898
H Acceptors:
3
H Donors:
3
Rotatable Bonds:
3