1-Nitrododecane

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C12H25NO2
Molecular Weight	215.3324
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-Nitrododecane

Structure Search

SMILES

CCCCCCCCCCCC[N+]([O-])=O

InChI

InChIKey=MQEMKUTWMALMCC-UHFFFAOYSA-N

InChI=1S/C12H25NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13(14)15/h2-12H2,1H3

HIDE SMILES / InChI

Molecular Formula	C12H25NO2
Molecular Weight	215.3324
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:30:23 GMT 2023` Edited by `admin` on `Sat Dec 16 18:30:23 GMT 2023`
Record UNII	9JRZ4JLN9M
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

1-Nitrododecane

Systematic Name

English

Dodecane, 1-nitro-

Systematic Name

English

NSC-76735

Code

English

Code System Code Type Description

FDA UNII

9JRZ4JLN9M

Created by admin on Sat Dec 16 18:30:23 GMT 2023 , Edited by admin on Sat Dec 16 18:30:23 GMT 2023

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ECHA (EC/EINECS)

240-929-0

Created by admin on Sat Dec 16 18:30:23 GMT 2023 , Edited by admin on Sat Dec 16 18:30:23 GMT 2023

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EPA CompTox

DTXSID70168626

Created by admin on Sat Dec 16 18:30:23 GMT 2023 , Edited by admin on Sat Dec 16 18:30:23 GMT 2023

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CAS

16891-99-9

Created by admin on Sat Dec 16 18:30:23 GMT 2023 , Edited by admin on Sat Dec 16 18:30:23 GMT 2023

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PUBCHEM

85629

Created by admin on Sat Dec 16 18:30:23 GMT 2023 , Edited by admin on Sat Dec 16 18:30:23 GMT 2023

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NSC

76735

Created by admin on Sat Dec 16 18:30:23 GMT 2023 , Edited by admin on Sat Dec 16 18:30:23 GMT 2023

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