CS-0045996
Ethyl 6-amino-2-chloro-5-nitropyrimidine-4-carboxylate
Manufacturer: ChemScene
CAS Number: 15949-13-0
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Purity
97%
MDL No
None
Storage
-20°C, protect from light, stored under nitrogen
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₇H₇ClN₄O₄
Molecular Weight
246.61
Synonyms
4-Pyrimidinecarboxylic acid, 6-amino-2-chloro-5-nitro-, ethyl ester
SMILES
O=C(C1=NC(Cl)=NC(N)=C1[N+]([O-])=O)OCC
Tpsa
121.24
Logp
0.7971
H Acceptors
7
H Donors
1
Rotatable Bonds
3
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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: 97%
MDL No: None
Storage: -20°C, protect from light, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₇ClN₄O₄
Molecular Weight: 246.61
Synonyms: 4-Pyrimidinecarboxylic acid, 6-amino-2-chloro-5-nitro-, ethyl ester
SMILES: O=C(C1=NC(Cl)=NC(N)=C1[N+]([O-])=O)OCC
Tpsa: 121.24
Logp: 0.7971
H Acceptors: 7
H Donors: 1
Rotatable Bonds: 3
Purity:
97%
MDL No:
None
Storage:
-20°C, protect from light, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₇ClN₄O₄
Molecular Weight:
246.61
Synonyms:
4-Pyrimidinecarboxylic acid, 6-amino-2-chloro-5-nitro-, ethyl ester
SMILES:
O=C(C1=NC(Cl)=NC(N)=C1[N+]([O-])=O)OCC
Tpsa:
121.24
Logp:
0.7971
H Acceptors:
7
H Donors:
1
Rotatable Bonds:
3
Purity: 97%
MDL No: None
Storage: 4°C, protect from light, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₇H₁₁N₃S
Molecular Weight: 169.25
Synonyms: None
SMILES: NC1=NC(SC)=NC(C)=C1C
Tpsa: 51.8
Logp: 1.39754
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 1
Purity:
97%
MDL No:
None
Storage:
4°C, protect from light, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₇H₁₁N₃S
Molecular Weight:
169.25
Synonyms:
None
SMILES:
NC1=NC(SC)=NC(C)=C1C
Tpsa:
51.8
Logp:
1.39754
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
1
Purity: 97%
MDL No: MFCD28664028
Storage: -20°C, protect from light, stored under nitrogen
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₆H₆ClIN₂OS
Molecular Weight: 316.55
Synonyms: None
SMILES: CSC1=NC(OC)=C(I)C(Cl)=N1
Tpsa: 35.01
Logp: 2.4651
H Acceptors: 4
H Donors: 0
Rotatable Bonds: 2
Purity:
97%
MDL No:
MFCD28664028
Storage:
-20°C, protect from light, stored under nitrogen
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₆H₆ClIN₂OS
Molecular Weight:
316.55
Synonyms:
None
SMILES:
CSC1=NC(OC)=C(I)C(Cl)=N1
Tpsa:
35.01
Logp:
2.4651
H Acceptors:
4
H Donors:
0
Rotatable Bonds:
2
Purity: 97%
MDL No: MFCD27986616
Storage: -20°C, sealed storage, away from moisture and light
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₅H₅Cl₂N₃
Molecular Weight: 178.02
Synonyms: None
SMILES: CNC1=NC=NC(Cl)=C1Cl
Tpsa: 37.81
Logp: 1.8251
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 1
Purity:
97%
MDL No:
MFCD27986616
Storage:
-20°C, sealed storage, away from moisture and light
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₅H₅Cl₂N₃
Molecular Weight:
178.02
Synonyms:
None
SMILES:
CNC1=NC=NC(Cl)=C1Cl
Tpsa:
37.81
Logp:
1.8251
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
1