CS-0561870
(E)-4-(2-(3-bromobenzoyl)hydrazinyl)-4-oxobut-2-enoic acid
Manufacturer: ChemScene
CAS Number: 1164473-04-4
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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
C₁₁H₉BrN₂O₄
Molecular Weight
313.10
Synonyms
(E)-4-[2-(3-bromobenzoyl)hydrazino]-4-oxo-2-butenoic acid
SMILES
O=C(O)/C=C/C(NNC(C1=CC=CC(Br)=C1)=O)=O
Tpsa
95.5
Logp
0.8509
H Acceptors
3
H Donors
3
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: C₁₁H₉BrN₂O₄
Molecular Weight: 313.10
Synonyms: (E)-4-[2-(3-bromobenzoyl)hydrazino]-4-oxo-2-butenoic acid
SMILES: O=C(O)/C=C/C(NNC(C1=CC=CC(Br)=C1)=O)=O
Tpsa: 95.5
Logp: 0.8509
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:
C₁₁H₉BrN₂O₄
Molecular Weight:
313.10
Synonyms:
(E)-4-[2-(3-bromobenzoyl)hydrazino]-4-oxo-2-butenoic acid
SMILES:
O=C(O)/C=C/C(NNC(C1=CC=CC(Br)=C1)=O)=O
Tpsa:
95.5
Logp:
0.8509
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: C₈H₁₄N₂O
Molecular Weight: 154.21
Synonyms: None
SMILES: C1CC(C1)NC(=O)C2CNC2
Tpsa: 41.13
Logp: -0.1255
H Acceptors: 2
H Donors: 2
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:
C₈H₁₄N₂O
Molecular Weight:
154.21
Synonyms:
None
SMILES:
C1CC(C1)NC(=O)C2CNC2
Tpsa:
41.13
Logp:
-0.1255
H Acceptors:
2
H Donors:
2
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: C₁₇H₁₅NO₃S
Molecular Weight: 313.37
Synonyms: None
SMILES: COC1=CC=C(C=C1)C2=NC3=CC=CC=C3SC(C2)C(=O)O
Tpsa: 58.89
Logp: 3.765
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:
C₁₇H₁₅NO₃S
Molecular Weight:
313.37
Synonyms:
None
SMILES:
COC1=CC=C(C=C1)C2=NC3=CC=CC=C3SC(C2)C(=O)O
Tpsa:
58.89
Logp:
3.765
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: C₁₀H₁₇NO₄
Molecular Weight: 215.25
Synonyms: None
SMILES: [C@H](NC(=O)C1CCCO1)([C@H](C)C)C(O)=O
Tpsa: 75.63
Logp: 0.3908
H Acceptors: 3
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:
C₁₀H₁₇NO₄
Molecular Weight:
215.25
Synonyms:
None
SMILES:
[C@H](NC(=O)C1CCCO1)([C@H](C)C)C(O)=O
Tpsa:
75.63
Logp:
0.3908
H Acceptors:
3
H Donors:
2
Rotatable Bonds:
4