Encyclopedia / Others

1-BroMoheptane--d7 structure

1-BroMoheptane--d7

CAS：1219802-55-7
MW:186.141132446
MF：C7H15Br

Email Tweet Share

Names and ldentifier
Computational chemical data
Realated Product Infomation

1. Names and Identifiers

1.1 Name: 1-BroMoheptane--d7

1.2 CAS No.: 1219802-55-7

1.3 CID: 131701124

1.4 Molecular Formula: C7H15Br

1.5 Inchi: InChI=1S/C7H15Br/c1-2-3-4-5-6-7-8/h2-7H2,1H3

1.6 InChkey: LSXKDWGTSHCFPP-UHFFFAOYSA-N

1.7 Canonical Smiles: CCCCCCCBr

1.8 Isomers Smiles: CCCCCCCBr

2. Computed Properties

Molecular Weight：186.141132446g/mol
Molecular Formula：C₇H₁₅Br
Compound Is Canonicalized：True
XLogP3-AA：185.07965
Monoisotopic Mass：185.07965
Complexity：35.4
Rotatable Bond Count：5
Hydrogen Bond Donor Count：0
Hydrogen Bond Acceptor Count：0
Topological Polar Surface Area：0
Heavy Atom Count：：8
Defined Atom Stereocenter Count：0
Undefined Atom Stereocenter Count：1
Defined Bond Stereocenter Count：0
Undefined Bond Stereocenter Count：0
Isotope Atom Count：7
Covalently-Bonded Unit Count：1
CACTVS Substructure Key Fingerprint：AAADccBgAAAAEAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGABAAAABSACAAAACAAAAAAAAAAAAAAAAAAAAAAAAAAAAACAAAAIAAAAAAAAAAAAAAAEAgAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==

3. Toltal 3 Suppliers View more

1-Bromoheptane--d7

Clearsynth Labs Limited

Tel: Update Time:2019/02/25

inquire

Clearsynth

Tel: Update Time:2022/01/01

inquire

1-Bromoheptane-5,5,6,6,7,7,7-d7

C/D/N Isotopes Inc.

Tel: Update Time:2022/01/01

inquire

4. Realated Product Infomation

1. Names and Identifiers

1.1 Name
1.2 CAS No.
1.3 Molecular Formula
1.4 Inchi
1.5 InChkey
1.6 Canonical Smiles
1.7 Isomers Smiles

2. Computational chemical data

3. Toltal 3 Suppliers

4. Realated Product Infomation

CAS Products Suppliers

Popular Searches

Request For Quotation