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Nsc149997

Nsc149997 structure

CAS No:
70925-11-0
Formula:
C8H14N2O2
Chemical Name:
Nsc149997
Synonyms:
Nsc149997;rel-(1R,2R)-1,2-Cyclohexanedicarboxamide;1,2-Cyclohexanedicarboxamide, (1R,2R)-rel-

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Nsc149997 Basic Attributes

Molecular Weight：

170.21

Exact Mass：

170.105527694 g/mol

NSC Number：

149997|11701

DSSTox ID：

DTXSID50279209

Characteristics

PSA：

86.2 Å²

Density：

1.188±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)

Boiling Point：

471.777±25.00 °C(Press: 760.00 Torr)(predicted)

PKA：

16.279±0.40(predicted)

Computed Properties

Molecular Weight:170.21
XLogP3:-0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:170.105527694
Monoisotopic Mass:170.105527694
Topological Polar Surface Area:86.2
Heavy Atom Count:12
Complexity:181
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Nsc149997

Basic Attributes
Characteristics
Computed Properties

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