对苯二酚单乙醚

Description

TRANS-2-HEPTENAL is identified by CAS 2463-63-0, molecular formula C7H12O and molecular weight 112.09 g/mol. UNII NS00021928; ChEBI 61724; InChIKey NDFKTBCGKNOHPJ-UHFFFAOYSA-N.

Identification

CAS Registry Number	2463-63-0
PubChem CID	17167
Molecular formula	C7H12O
Molecular weight	112.09 g/mol
IUPAC name	hept-2-enal
InChIKey	NDFKTBCGKNOHPJ-UHFFFAOYSA-N
UNII (FDA)	NS00021928
ChEBI ID	CHEBI:61724

Computed Descriptors

Molecular Weight	112.17
XLogP3	2.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	4
Exact Mass	112.088815002
Monoisotopic Mass	112.088815002
Topological Polar Surface Area	17.1
Heavy Atom Count	8
Formal Charge	0

Synonyms

2-Hepten-1-al; CHEBI:61724; n-hept-2-enal; (E);-Hept-2-enal; Epitope ID:143638; SCHEMBL120185; SCHEMBL514956; NDFKTBCGKNOHPJ-UHFFFAOYSA-N; SB85381; DB-044672; DB-261073; NS00021928

Frequently Asked Questions

What are the CAS number and molecular formula of TRANS-2-HEPTENAL?

CAS 2463-63-0; molecular formula C7H12O; molecular weight 112.09 g/mol.

What other names is TRANS-2-HEPTENAL known by?

2-Hepten-1-al, CHEBI:61724, n-hept-2-enal, (E);-Hept-2-enal, Epitope ID:143638, SCHEMBL120185.

Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.