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diacetylputrescine

diacetylputrescine structure

CAS No:
3073-57-2
Formula:
C8H16N2O2
Chemical Name:
diacetylputrescine
Synonyms:
diacetylputrescine;tetramethylenebisacetamide;TMBA;N-acetyl-N-(4-aminobutyl)acetamide;SCHEMBL10448893;CTK4G5788;DTXSID40184752;Acetamide,N,N"-1,4-butanediylbis-
Categories:
Organic Chemistry > Amides

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diacetylputrescine Basic Attributes

Molecular Weight：

172.228

Exact Mass：

172.121

DSSTox ID：

DTXSID40184752

Characteristics

PSA：

63.4

XLogP3：

-0.7

Density：

0.998±0.06 g/cm3(Predicted)

Melting Point：

137-138.5 °C(Solv: ethyl acetate (141-78-6))

Drug Information

MeSH Entry Terms：

diacetylputrescine

Computed Properties

Molecular Weight:172.22
XLogP3:-0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:172.121177757
Monoisotopic Mass:172.121177757
Topological Polar Surface Area:63.4
Heavy Atom Count:12
Complexity:154
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes