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3-METHYL-4-NITRO-BUTYRICACIDETHYLESTER

3-METHYL-4-NITRO-BUTYRICACIDETHYLESTER structure

CAS No:
2985-50-4
Formula:
C7H13NO4
Chemical Name:
3-METHYL-4-NITRO-BUTYRICACIDETHYLESTER
Synonyms:
ETHYL 3-METHYL-4-NITROBUTANOATE;3-METHYL-4-NITRO-BUTYRIC ACID ETHYL ESTER;Butanoic acid, 3-methyl-4-nitro-, ethyl ester;3-methyl-4-nitrobutyric acid ethyl ester;SCHEMBL4310347;CTK4G3918;DTXSID90469682;Oxolan-2-ylmethyl2-hydroxybenzoate;AKOS006290858;AKOS015966026

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3-METHYL-4-NITRO-BUTYRICACIDETHYLESTER Basic Attributes

Molecular Weight：

175.18200

Exact Mass：

175.08400

DSSTox ID：

DTXSID90469682

Characteristics

PSA：

72.12000

XLogP3：

1.37560

Computed Properties

Molecular Weight:175.18
XLogP3:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:175.08445790
Monoisotopic Mass:175.08445790
Topological Polar Surface Area:72.1
Heavy Atom Count:12
Complexity:163
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-METHYL-4-NITRO-BUTYRICACIDETHYLESTER

Basic Attributes
Characteristics
Computed Properties

3-METHYL-4-NITRO-BUTYRICACIDETHYLESTER

SDS

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