Decamethylene diisocyanate

HCID 138285
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Basic information

CAS
4538-39-0
Standard SMILES
O=C=NCCCCCCCCCCN=C=O
InChIKey
VNMOIBZLSJDQEO-UHFFFAOYSA-N
Molecular formula
C12H20N2O2
Average molar mass
224.3 g/mol
Monoisotopic mass
224.15247789

Names & identifiers

Preferred name
Decamethylene diisocyanate
IUPAC
1,10-diisocyanatodecane
English name
1,10-diisocyanatodecane
Molecular formula
C12H20N2O2
Molecular weight
224.3

Names & synonyms

Decamethylene diisocyanate4538-39-0DTXSID00196492RefChem:336691DTXCID101189831,10-diisocyanatodecaneSCHEMBL48313decane-1,10-diyl diisocyanateVNMOIBZLSJDQEO-UHFFFAOYSA-NMFCD27950902SY275466Decane, 1,10-diisocyanato-

Database identifiers

CAS
4538-39-0
PubChem CID
138285
DTXSID
DTXSID00196492
Nikkaji
J803.912G

Properties

Computed structural properties

XLogP
5.4
Topological polar surface area
58.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
11
Heavy atoms
16

Physicochemical properties

Boiling point
154 · 154-157 °C(Press: 4.5 Torr)
Density
0.97 · 0.97±0.1 g/cm3(Predicted)

Chemistry & industry

Suppliers9 total

上海相辉医药科技有限公司13761987713; 13761987713 · [email protected]
武汉丰泰威远科技有限公司+86-27-8746-5837 +86-18627785180 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
吉林中科研伸科技有限公司18143011203 · [email protected]
韶远科技(上海)有限公司021-50795510 4000665055 · [email protected]

Related reactions

3 records
New reaction record

Compound notes

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