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Dibromomaleimide-C5-COOH

CAT: 0607-BA2494-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-BA2494-10Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1443214-97-8
Form
A solid
Molecular Formula
C10H11Br2NO4
Molecular Weight
369.01
Shipping Conditions
Blue ice
Storage Conditions
4°C.

Chemical Information

Dibromomaleimide-C5-COOH
CAS Number1443214-97-8
PubChem CID89614169
IUPAC Name6-(3,4-dibromo-2,5-dioxopyrrol-1-yl)hexanoic acid
Molecular FormulaC10H11Br2NO4
Molecular Weight369.01
XLogP1.9
Topological Polar Surface Area74.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count17
Formal Charge0
Complexity368
SMILES
C(CCC(=O)O)CCN1C(=O)C(=C(C1=O)Br)Br
InChI
InChI=1S/C10H11Br2NO4/c11-7-8(12)10(17)13(9(7)16)5-3-1-2-4-6(14)15/h1-5H2,(H,14,15)
InChIKey
XABAXSUMIXSPEP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dibromomaleimide-C5-COOH
CAS: 1443214-97-8
CID: 89614169
Formula: C10H11Br2NO4
MW: 369.01
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight369.01
XLogP31.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass368.90343
Monoisotopic Mass366.90548
Topological Polar Surface Area74.7 Ų
Heavy Atom Count17
Formal Charge0
Complexity368
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes