Trineopentyl orthoborate

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C15H33BO3
Molecular Weight	272.232
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Trineopentyl orthoborate

Structure Search

SMILES

CC(C)(C)COB(OCC(C)(C)C)OCC(C)(C)C

InChI

InChIKey=CTMRSRYEXZZLLP-UHFFFAOYSA-N

InChI=1S/C15H33BO3/c1-13(2,3)10-17-16(18-11-14(4,5)6)19-12-15(7,8)9/h10-12H2,1-9H3

HIDE SMILES / InChI

Molecular Formula	C15H33BO3
Molecular Weight	272.232
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 11:51:40 GMT 2023` Edited by `admin` on `Sat Dec 16 11:51:40 GMT 2023`
Record UNII	B87DY32KJ9
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Trineopentyl orthoborate

Systematic Name

English

1-Propanol, 2,2-dimethyl-, triester with boric acid (H3BO3)

Common Name

English

NSC-7433

Code

English

Code System Code Type Description

NSC

7433

Created by admin on Sat Dec 16 11:51:40 GMT 2023 , Edited by admin on Sat Dec 16 11:51:40 GMT 2023

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PUBCHEM

79559

Created by admin on Sat Dec 16 11:51:40 GMT 2023 , Edited by admin on Sat Dec 16 11:51:40 GMT 2023

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CAS

5456-06-4

Created by admin on Sat Dec 16 11:51:40 GMT 2023 , Edited by admin on Sat Dec 16 11:51:40 GMT 2023

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EPA CompTox

DTXSID00202981

Created by admin on Sat Dec 16 11:51:40 GMT 2023 , Edited by admin on Sat Dec 16 11:51:40 GMT 2023

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ECHA (EC/EINECS)

226-712-3

Created by admin on Sat Dec 16 11:51:40 GMT 2023 , Edited by admin on Sat Dec 16 11:51:40 GMT 2023

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FDA UNII

B87DY32KJ9

Created by admin on Sat Dec 16 11:51:40 GMT 2023 , Edited by admin on Sat Dec 16 11:51:40 GMT 2023

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