2-NITROANTHRACENE-7,8-DIHYDRODIOL, TRANS-

Details

Stereochemistry	RACEMIC
Molecular Formula	C14H11NO4
Molecular Weight	257.2414
Optical Activity	( + / - )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-NITROANTHRACENE-7,8-DIHYDRODIOL, TRANS-

Structure Search

SMILES

O[C@H]1C=CC2=C(C=C3C=C(C=CC3=C2)[N+]([O-])=O)[C@@H]1O

InChI

InChIKey=YBKLCCBQPCUDIE-KBPBESRZSA-N

InChI=1S/C14H11NO4/c16-13-4-2-9-5-8-1-3-11(15(18)19)6-10(8)7-12(9)14(13)17/h1-7,13-14,16-17H/t13-,14-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C14H11NO4
Molecular Weight	257.2414
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:51:17 GMT 2025` Edited by `admin` on `Mon Mar 31 21:51:17 GMT 2025`
Record UNII	88OVD3O7X7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-NITROANTHRACENE-7,8-DIHYDRODIOL, TRANS-

Common Name

English

2-NITROANTHRACENE TRANS 7,8-DIHYDRODIOL

Preferred Name

English

TRANS-7,8-DIHYDROXY-2-NITRO-7,8-DIHYDROANTHRACENE

Systematic Name

English

1,2-ANTHRACENEDIOL, 1,2-DIHYDRO-7-NITRO-, (1R,2R)-REL-

Systematic Name

English

1,2-ANTHRACENEDIOL, 1,2-DIHYDRO-7-NITRO-, TRANS-

Systematic Name

English

2-NITROANTHRACENE-7,8-DIHYDRODIOL, TRANS-(±)-

Common Name

English

Code System Code Type Description

PUBCHEM

21150209

Created by admin on Mon Mar 31 21:51:17 GMT 2025 , Edited by admin on Mon Mar 31 21:51:17 GMT 2025

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FDA UNII

88OVD3O7X7

Created by admin on Mon Mar 31 21:51:17 GMT 2025 , Edited by admin on Mon Mar 31 21:51:17 GMT 2025

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EPA CompTox

DTXSID10911390

Created by admin on Mon Mar 31 21:51:17 GMT 2025 , Edited by admin on Mon Mar 31 21:51:17 GMT 2025

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CAS

109897-78-1

Created by admin on Mon Mar 31 21:51:17 GMT 2025 , Edited by admin on Mon Mar 31 21:51:17 GMT 2025

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