CS-1003834
4(3H)-Pyrimidinone, 2,5,6-triamino-, hydrochloride 1:1
Manufacturer: ChemScene
CAS Number: 4066-47-1
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Purity
≥95%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₄H₈ClN₅O
Molecular Weight
177.59
Synonyms
None
SMILES
Cl.O=C1N=C(N)NC(N)=C1N
Tpsa
123.81
Logp
-1.0617
H Acceptors
5
H Donors
4
Rotatable Bonds
0
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
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: ≥95%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₄H₈ClN₅O
Molecular Weight: 177.59
Synonyms: None
SMILES: Cl.O=C1N=C(N)NC(N)=C1N
Tpsa: 123.81
Logp: -1.0617
H Acceptors: 5
H Donors: 4
Rotatable Bonds: 0
Purity:
≥95%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₄H₈ClN₅O
Molecular Weight:
177.59
Synonyms:
None
SMILES:
Cl.O=C1N=C(N)NC(N)=C1N
Tpsa:
123.81
Logp:
-1.0617
H Acceptors:
5
H Donors:
4
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: C₁₄H₁₀O₅
Molecular Weight: 258.23
Synonyms: None
SMILES: O=C(O)C1=CC=C(OC(=O)C2=CC=C(O)C=C2)C=C1
Tpsa: 83.83
Logp: 2.3096
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:
C₁₄H₁₀O₅
Molecular Weight:
258.23
Synonyms:
None
SMILES:
O=C(O)C1=CC=C(OC(=O)C2=CC=C(O)C=C2)C=C1
Tpsa:
83.83
Logp:
2.3096
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: C₁₂H₁₇FN₂O
Molecular Weight: 224.27
Synonyms: None
SMILES: FC1=CC=CC(=C1)CN2CCOC(CN)C2
Tpsa: 38.49
Logp: 0.9852
H Acceptors: 3
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:
C₁₂H₁₇FN₂O
Molecular Weight:
224.27
Synonyms:
None
SMILES:
FC1=CC=CC(=C1)CN2CCOC(CN)C2
Tpsa:
38.49
Logp:
0.9852
H Acceptors:
3
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: C₂₁H₁₈O₉
Molecular Weight: 414.36
Synonyms: None
SMILES: O=C(O)C=1OC2=CC=CC(OCC(O)COC=3C=CC=C(O)C3C(=O)C)=C2C(=O)C1
Tpsa: 143.5
Logp: 2.2181
H Acceptors: 8
H Donors: 3
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:
C₂₁H₁₈O₉
Molecular Weight:
414.36
Synonyms:
None
SMILES:
O=C(O)C=1OC2=CC=CC(OCC(O)COC=3C=CC=C(O)C3C(=O)C)=C2C(=O)C1
Tpsa:
143.5
Logp:
2.2181
H Acceptors:
8
H Donors:
3
Rotatable Bonds:
8