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SB297006

SB297006 structure

CAS No:
58816-69-6
Formula:
C18H18N2O5
Chemical Name:
SB297006
Synonyms:
N-Benzoyl-4-nitroaniline ethyl ester;CS-2882;SB 297006;ethyl (2S)-2-(benzoylaMino)-3-(4-nitrophenyl)propanoate;N-Benzoyl-4-nitro-L-phenylalanine ethyl ester;L-Phenylalanine, N-benzoyl-4-nitro-, ethyl ester;(S)-Ethyl 2-benzamido-3-(4-nitrophenyl)propanoate

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SB297006 Basic Attributes

Molecular Weight：

342.35

Exact Mass：

342.12157168

Characteristics

Density：

1.257±0.06 g/cm3

Melting Point：

121 °C

Boiling Point：

573.0±45.0 °C(Predicted)

PKA：

12.84±0.46

Safety Information

Transport codes：

UN 3077 9 / PGIII

wgk germany：

hazard class code：

22-50

safety instructions：

Marks：

Xn,N

Drug Information

MeSH Entry Terms：

ethyl 2-benzoylamino-3-(4-nitrophenyl)propionate

Computed Properties

Molecular Weight:342.3
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:342.12157168
Monoisotopic Mass:342.12157168
Topological Polar Surface Area:101
Heavy Atom Count:25
Complexity:463
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of SB297006

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties

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